7H-Purine-7-acetic acid, 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-, compd. with 2-(diphenylmethoxy)-N,N-dimethylethanamine (1:1)

CAS Registry Number®

857401-00-4
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CAS Name

7H-Purine-7-acetic acid, 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-, compd. with 2-(diphenylmethoxy)-N,N-dimethylethanamine (1:1)

Molecular Formula

C17H21NO.C9H10N4O4

Cite this Page

7H-Purine-7-acetic acid, 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-, compd. with 2-(diphenylmethoxy)-N,N-dimethylethanamine (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=857401-00-4 (retrieved 2024-07-16) (CAS RN: 857401-00-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H21NO.C9H10N4O4/c1-18(2)13-14-19-17(15-9-5-3-6-10-15)16-11-7-4-8-12-16;1-11-7-6(8(16)12(2)9(11)17)13(4-10-7)3-5(14)15/h3-12,17H,13-14H2,1-2H3;4H,3H2,1-2H3,(H,14,15)

InChIKey

InChIKey=UFKLOBYBVCBTBP-UHFFFAOYSA-N

SMILES

C(C(O)=O)N1C2=C(N(C)C(=O)N(C)C2=O)N=C1.C(OCCN(C)C)(C1=CC=CC=C1)C2=CC=CC=C2

Canonical SMILES

O=C(O)CN1C=NC2=C1C(=O)N(C(=O)N2C)C.O(CCN(C)C)C(C=1C=CC=CC1)C=2C=CC=CC2

Other Names for this Substance

  • 7H-Purine-7-acetic acid, 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-, compd. with 2-(diphenylmethoxy)-N,N-dimethylethanamine (1:1)
  • 7-Purineacetic acid, 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-, compd. with diphenhydramine
  • Etanautine