1-Pentanol, 5-[(6,7,8-trimethoxy-4-quinazolinyl)amino]-, nitrate (ester), (2Z)-2-butenedioate (1:1) (salt)

CAS Registry Number®

54567-65-6

CAS Name

1-Pentanol, 5-[(6,7,8-trimethoxy-4-quinazolinyl)amino]-, nitrate (ester), (2Z)-2-butenedioate (1:1) (salt)

Molecular Formula

C16H22N4O6.C4H4O4

Cite this Page

1-Pentanol, 5-[(6,7,8-trimethoxy-4-quinazolinyl)amino]-, nitrate (ester), (2Z)-2-butenedioate (1:1) (salt).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=54567-65-6 (retrieved 2024-11-26) (CAS RN: 54567-65-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H22N4O6.C4H4O4/c1-23-12-9-11-13(15(25-3)14(12)24-2)18-10-19-16(11)17-7-5-4-6-8-26-20(21)22;5-3(6)1-2-4(7)8/h9-10H,4-8H2,1-3H3,(H,17,18,19);1-2H,(H,5,6)(H,7,8)/b;2-1-

InChIKey

InChIKey=HYJLIYABULAXFC-BTJKTKAUSA-N

SMILES

N(CCCCCON(=O)=O)C=1C2=C(C(OC)=C(OC)C(OC)=C2)N=CN1.C(=C\C(O)=O)\C(O)=O

Canonical SMILES

O=C(O)C=CC(=O)O.O=N(=O)OCCCCCNC1=NC=NC=2C(OC)=C(OC)C(OC)=CC12

Other Names for this Substance

  • 1-Pentanol, 5-[(6,7,8-trimethoxy-4-quinazolinyl)amino]-, nitrate (ester), (2Z)-2-butenedioate (1:1) (salt)
  • 1-Pentanol, 5-[(6,7,8-trimethoxy-4-quinazolinyl)amino]-, nitrate (ester), (Z)-2-butenedioate (1:1) (salt)
  • KT 1
  • KT 1 (pharmaceutical)

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