1-(azepan-1-yl)-3-(4-ethoxyphenyl)-4-methyl-2-phenyl-pentan-3-ol hydrochloride

Systemtic Name: 1-(azepan-1-yl)-3-(4-ethoxyphenyl)-4-methyl-2-phenyl-pentan-3-ol hydrochloride Openeye Name: 1-(azepan-1-yl)-3-(4-ethoxyphenyl)-4-methyl-2-phenyl-pentan-3-ol hydrochloride CAS Name: 1-(1-azepanyl)-3-(4-ethoxyphenyl)-4-methyl-2-phenyl-3-pentanol hydrochloride IUPAC Name: 1-(azepan-1-yl)-3-(4-ethoxyphenyl)-4-methyl-2-phenylpentan-3-ol hydrochloride Traditional Name: 1-(azepan-1-yl)-4-methyl-2-phenyl-3-p-phenetyl-pentan-3-ol hydrochloride Formula: C26H38ClNO2 MolecularWeight: 432.03842

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(C(C)C)(C(CN2CCCCCC2)C3=CC=CC=C3)O.Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)C(C(C)C)(C(CN2CCCCCC2)C3=CC=CC=C3)O.Cl

InChI

InChI=1S/C26H37NO2.ClH/c1-4-29-24-16-14-23(15-17-24)26(28,21(2)3)25(22-12-8-7-9-13-22)20-27-18-10-5-6-11-19-27;/h7-9,12-17,21,25,28H,4-6,10-11,18-20H2,1-3H3;1H