2-Naphthacenecarboxamide, 4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-N-(1-pyrrolidinylmethyl)-, [4S-(4α,4aα,5aα,6β,12aα)]-, nitrate (salt)

CAS Registry Number®

7681-32-5
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CAS Name

2-Naphthacenecarboxamide, 4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-N-(1-pyrrolidinylmethyl)-, [4S-(4α,4aα,5aα,6β,12aα)]-, nitrate (salt)

Molecular Formula

C27H33N3O8.xHNO3

Cite this Page

2-Naphthacenecarboxamide, 4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-N-(1-pyrrolidinylmethyl)-, [4S-(4α,4aα,5aα,6β,12aα)]-, nitrate (salt).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=7681-32-5 (retrieved 2024-09-11) (CAS RN: 7681-32-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C27H33N3O8.HNO3/c1-26(37)13-7-6-8-16(31)17(13)21(32)18-14(26)11-15-20(29(2)3)22(33)19(24(35)27(15,38)23(18)34)25(36)28-12-30-9-4-5-10-30;2-1(3)4/h6-8,14-15,20,31,33-34,37-38H,4-5,9-12H2,1-3H3,(H,28,36);(H,2,3,4)/t14-,15-,20-,26+,27-;/m0./s1

InChIKey

InChIKey=BQYJYUVCGMONDI-HDJCBORZSA-N

SMILES

N(=O)(=O)O.O[C@]12[C@]([C@H](N(C)C)C(O)=C(C(NCN3CCCC3)=O)C1=O)(C[C@]4(C(=C2O)C(=O)C=5C([C@@]4(C)O)=CC=CC5O)[H])[H]

Canonical SMILES

O=C(NCN1CCCC1)C=2C(=O)C3(O)C(O)=C4C(=O)C=5C(O)=CC=CC5C(O)(C)C4CC3C(C2O)N(C)C.O=N(=O)O

Other Names for this Substance

  • 2-Naphthacenecarboxamide, 4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-N-(1-pyrrolidinylmethyl)-, [4S-(4α,4aα,5aα,6β,12aα)]-, nitrate (salt)
  • 2-Naphthacenecarboxamide, 4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-N-(1-pyrrolidinylmethyl)-, nitrate (salt)
  • 4-(Dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-N-(1-pyrrolidonylmethyl)-2-naphthacenecarboxamide nitrate sesquihydrate
  • Tetrim
  • Tetriv

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