5H-Dibenz[b,f]azepine-5-propanaminium, N-β-D-glucopyranuronosyl-10,11-dihydro-N,N-dimethyl-, inner salt
CAS Registry Number®
165602-94-8
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CAS Name
5H-Dibenz[b,f]azepine-5-propanaminium, N-β-D-glucopyranuronosyl-10,11-dihydro-N,N-dimethyl-, inner saltMolecular Formula
C25H32N2O6Cite this Page
5H-Dibenz[b,f]azepine-5-propanaminium, N-β-D-glucopyranuronosyl-10,11-dihydro-N,N-dimethyl-, inner salt. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=165602-94-8 (retrieved ) (CAS RN: 165602-94-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C25H32N2O6/c1-27(2,24-22(30)20(28)21(29)23(33-24)25(31)32)15-7-14-26-18-10-5-3-8-16(18)12-13-17-9-4-6-11-19(17)26/h3-6,8-11,20-24,28-30H,7,12-15H2,1-2H3/t20-,21-,22+,23-,24+/m0/s1
InChIKey
InChIKey=CXPKQHSXFUNBMP-OSFFKXSWSA-N
SMILES
C(CC[N+](C)(C)[C@@H]1O[C@H](C([O-])=O)[C@@H](O)[C@H](O)[C@H]1O)N2C=3C(CCC=4C2=CC=CC4)=CC=CC3
Canonical SMILES
O=C([O-])C1OC(C(O)C(O)C1O)[N+](C)(C)CCCN2C=3C=CC=CC3CCC=4C=CC=CC42
Other Names for this Substance
- 5H-Dibenz[b,f]azepine-5-propanaminium, N-β-D-glucopyranuronosyl-10,11-dihydro-N,N-dimethyl-, inner salt
- Imipramine N-glucuronide
