(E)-1-(4-methyl-1,4-diazepan-1-yl)-3-(2-methylphenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(4-methyl-1,4-diazepan-1-yl)-3-(2-methylphenyl)prop-2-en-1-one Openeye Name: (E)-1-(4-methyl-1,4-diazepan-1-yl)-3-(o-tolyl)prop-2-en-1-one CAS Name: (E)-1-(4-methyl-1,4-diazepan-1-yl)-3-(2-methylphenyl)-2-propen-1-one IUPAC Name: (E)-1-(4-methyl-1,4-diazepan-1-yl)-3-(2-methylphenyl)prop-2-en-1-one Traditional Name: (E)-1-(4-methyl-1,4-diazepan-1-yl)-3-(o-tolyl)prop-2-en-1-one Formula: C16H22N2O MolecularWeight: 258.35868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=CC(=O)N2CCCN(CC2)C

Isomeric SMILES

CC1=CC=CC=C1/C=C/C(=O)N2CCCN(CC2)C

InChI

InChI=1S/C16H22N2O/c1-14-6-3-4-7-15(14)8-9-16(19)18-11-5-10-17(2)12-13-18/h3-4,6-9H,5,10-13H2,1-2H3/b9-8+