2-(azepan-1-yl)-1-(4-methylphenyl)propan-1-one

Systemtic Name: 2-(azepan-1-yl)-1-(4-methylphenyl)propan-1-one Openeye Name: 2-(azepan-1-yl)-1-(p-tolyl)propan-1-one CAS Name: 2-(1-azepanyl)-1-(4-methylphenyl)-1-propanone IUPAC Name: 2-(azepan-1-yl)-1-(4-methylphenyl)propan-1-one Traditional Name: 2-(azepan-1-yl)-1-(p-tolyl)propan-1-one Formula: C16H23NO MolecularWeight: 245.35992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(C)N2CCCCCC2

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C(C)N2CCCCCC2

InChI

InChI=1S/C16H23NO/c1-13-7-9-15(10-8-13)16(18)14(2)17-11-5-3-4-6-12-17/h7-10,14H,3-6,11-12H2,1-2H3