(E)-1-(azepan-1-yl)-3-(4-methylphenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(azepan-1-yl)-3-(4-methylphenyl)prop-2-en-1-one Openeye Name: (E)-1-(azepan-1-yl)-3-(p-tolyl)prop-2-en-1-one CAS Name: (E)-1-(1-azepanyl)-3-(4-methylphenyl)-2-propen-1-one IUPAC Name: (E)-1-(azepan-1-yl)-3-(4-methylphenyl)prop-2-en-1-one Traditional Name: (E)-1-(azepan-1-yl)-3-(p-tolyl)prop-2-en-1-one Formula: C16H21NO MolecularWeight: 243.34404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO/c1-14-6-8-15(9-7-14)10-11-16(18)17-12-4-2-3-5-13-17/h6-11H,2-5,12-13H2,1H3/b11-10+