1-(azepan-1-yl)-4-(4-methylphenyl)butane-1,4-dione

Systemtic Name: 1-(azepan-1-yl)-4-(4-methylphenyl)butane-1,4-dione Openeye Name: 1-(azepan-1-yl)-4-(p-tolyl)butane-1,4-dione CAS Name: 1-(1-azepanyl)-4-(4-methylphenyl)butane-1,4-dione IUPAC Name: 1-(azepan-1-yl)-4-(4-methylphenyl)butane-1,4-dione Traditional Name: 1-(azepan-1-yl)-4-(p-tolyl)butane-1,4-dione Formula: C17H23NO2 MolecularWeight: 273.37002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23NO2/c1-14-6-8-15(9-7-14)16(19)10-11-17(20)18-12-4-2-3-5-13-18/h6-9H,2-5,10-13H2,1H3