2-[2-(azepan-1-yl)ethoxy]ethyl 2,2-diphenylcyclopropane-1-carboxylate hydrochloride

Systemtic Name: 2-[2-(azepan-1-yl)ethoxy]ethyl 2,2-diphenylcyclopropane-1-carboxylate hydrochloride Openeye Name: 2-[2-(azepan-1-yl)ethoxy]ethyl 2,2-diphenylcyclopropanecarboxylate hydrochloride CAS Name: 2,2-diphenyl-1-cyclopropanecarboxylic acid 2-[2-(1-azepanyl)ethoxy]ethyl ester hydrochloride IUPAC Name: 2-[2-(azepan-1-yl)ethoxy]ethyl 2,2-diphenylcyclopropane-1-carboxylate hydrochloride Traditional Name: 2,2-diphenylcyclopropanecarboxylic acid 2-[2-(azepan-1-yl)ethoxy]ethyl ester hydrochloride Formula: C26H34ClNO3 MolecularWeight: 444.00606

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCOCCOC(=O)C2CC2(C3=CC=CC=C3)C4=CC=CC=C4.Cl

Isomeric SMILES

C1CCCN(CC1)CCOCCOC(=O)C2CC2(C3=CC=CC=C3)C4=CC=CC=C4.Cl

InChI

InChI=1S/C26H33NO3.ClH/c28-25(30-20-19-29-18-17-27-15-9-1-2-10-16-27)24-21-26(24,22-11-5-3-6-12-22)23-13-7-4-8-14-23;/h3-8,11-14,24H,1-2,9-10,15-21H2;1H