(phenylmethyl) N-[4-methyl-1-[(3-methylphenyl)methyl]-3-oxidanylidene-1,4-diazepan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[4-methyl-1-[(3-methylphenyl)methyl]-3-oxidanylidene-1,4-diazepan-2-yl]carbamate Openeye Name: benzyl N-[4-methyl-1-(m-tolylmethyl)-3-oxo-1,4-diazepan-2-yl]carbamate CAS Name: N-[4-methyl-1-[(3-methylphenyl)methyl]-3-oxo-1,4-diazepan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[4-methyl-1-[(3-methylphenyl)methyl]-3-oxo-1,4-diazepan-2-yl]carbamate Traditional Name: N-[3-keto-4-methyl-1-(3-methylbenzyl)-1,4-diazepan-2-yl]carbamic acid benzyl ester Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCCN(C(=O)C2NC(=O)OCC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCCN(C(=O)C2NC(=O)OCC3=CC=CC=C3)C

InChI

InChI=1S/C22H27N3O3/c1-17-8-6-11-19(14-17)15-25-13-7-12-24(2)21(26)20(25)23-22(27)28-16-18-9-4-3-5-10-18/h3-6,8-11,14,20H,7,12-13,15-16H2,1-2H3,(H,23,27)