[3-(propanoylamino)phenyl] N-(2-cyanoethyl)-N-(2-methylphenyl)carbamate

Systemtic Name: [3-(propanoylamino)phenyl] N-(2-cyanoethyl)-N-(2-methylphenyl)carbamate Openeye Name: [3-(propanoylamino)phenyl] N-(2-cyanoethyl)-N-(o-tolyl)carbamate CAS Name: N-(2-cyanoethyl)-N-(2-methylphenyl)carbamic acid [3-(1-oxopropylamino)phenyl] ester IUPAC Name: [3-(propanoylamino)phenyl] N-(2-cyanoethyl)-N-(2-methylphenyl)carbamate Traditional Name: N-(2-cyanoethyl)-N-(o-tolyl)carbamic acid (3-propionamidophenyl) ester Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=CC=C1)OC(=O)N(CCC#N)C2=CC=CC=C2C

Isomeric SMILES

CCC(=O)NC1=CC(=CC=C1)OC(=O)N(CCC#N)C2=CC=CC=C2C

InChI

InChI=1S/C20H21N3O3/c1-3-19(24)22-16-9-6-10-17(14-16)26-20(25)23(13-7-12-21)18-11-5-4-8-15(18)2/h4-6,8-11,14H,3,7,13H2,1-2H3,(H,22,24)