3-(azepan-1-yl)-1-(4-ethylphenyl)propan-1-one hydrochloride

Systemtic Name: 3-(azepan-1-yl)-1-(4-ethylphenyl)propan-1-one hydrochloride Openeye Name: 3-(azepan-1-yl)-1-(4-ethylphenyl)propan-1-one hydrochloride CAS Name: 3-(1-azepanyl)-1-(4-ethylphenyl)-1-propanone hydrochloride IUPAC Name: 3-(azepan-1-yl)-1-(4-ethylphenyl)propan-1-one hydrochloride Traditional Name: 3-(azepan-1-yl)-1-(4-ethylphenyl)propan-1-one hydrochloride Formula: C17H26ClNO MolecularWeight: 295.84744

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)CCN2CCCCCC2.Cl

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)CCN2CCCCCC2.Cl

InChI

InChI=1S/C17H25NO.ClH/c1-2-15-7-9-16(10-8-15)17(19)11-14-18-12-5-3-4-6-13-18;/h7-10H,2-6,11-14H2,1H3;1H