Ethanaminium, 2-(diphenylmethoxy)-N-β-D-glucopyranuronosyl-N,N-dimethyl-, inner salt

CAS Registry Number®

137908-78-2
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CAS Name

Ethanaminium, 2-(diphenylmethoxy)-N-β-D-glucopyranuronosyl-N,N-dimethyl-, inner salt

Molecular Formula

C23H29NO7

Cite this Page

Ethanaminium, 2-(diphenylmethoxy)-N-β-D-glucopyranuronosyl-N,N-dimethyl-, inner salt.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=137908-78-2 (retrieved 2024-09-07) (CAS RN: 137908-78-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C23H29NO7/c1-24(2,22-19(27)17(25)18(26)21(31-22)23(28)29)13-14-30-20(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17-22,25-27H,13-14H2,1-2H3/t17-,18-,19+,21-,22+/m0/s1

InChIKey

InChIKey=OAIGZXXQYIJBLR-WJJPVSRMSA-N

SMILES

[N@+](CCOC(C1=CC=CC=C1)C2=CC=CC=C2)(C)(C)[C@@H]3O[C@H](C([O-])=O)[C@@H](O)[C@H](O)[C@H]3O

Canonical SMILES

O=C([O-])C1OC(C(O)C(O)C1O)[N+](C)(C)CCOC(C=2C=CC=CC2)C=3C=CC=CC3

Other Names for this Substance

  • Ethanaminium, 2-(diphenylmethoxy)-N-β-D-glucopyranuronosyl-N,N-dimethyl-, inner salt
  • Diphenhydramine N-glucuronide