4-[(2-methylphenyl)methyl]-1-[(E)-3-phenylprop-2-enyl]-1,4-diazepan-5-one

Systemtic Name: 4-[(2-methylphenyl)methyl]-1-[(E)-3-phenylprop-2-enyl]-1,4-diazepan-5-one Openeye Name: 1-[(E)-cinnamyl]-4-(o-tolylmethyl)-1,4-diazepan-5-one CAS Name: 4-[(2-methylphenyl)methyl]-1-[(E)-3-phenylprop-2-enyl]-1,4-diazepan-5-one IUPAC Name: 4-[(2-methylphenyl)methyl]-1-[(E)-3-phenylprop-2-enyl]-1,4-diazepan-5-one Traditional Name: 1-[(E)-cinnamyl]-4-(2-methylbenzyl)-1,4-diazepan-5-one Formula: C22H26N2O MolecularWeight: 334.45464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CCC2=O)CC=CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CCC2=O)C/C=C/C3=CC=CC=C3

InChI

InChI=1S/C22H26N2O/c1-19-8-5-6-12-21(19)18-24-17-16-23(15-13-22(24)25)14-7-11-20-9-3-2-4-10-20/h2-12H,13-18H2,1H3/b11-7+