methyl 2-[[2-cyanoethyl-(phenylmethyl)carbamoyl]amino]benzoate

Systemtic Name: methyl 2-[[2-cyanoethyl-(phenylmethyl)carbamoyl]amino]benzoate Openeye Name: methyl 2-[[benzyl(2-cyanoethyl)carbamoyl]amino]benzoate CAS Name: 2-[[[2-cyanoethyl-(phenylmethyl)amino]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[benzyl(2-cyanoethyl)carbamoyl]amino]benzoate Traditional Name: 2-[[benzyl(2-cyanoethyl)carbamoyl]amino]benzoic acid methyl ester Formula: C19H19N3O3 MolecularWeight: 337.37246

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)N(CCC#N)CC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)N(CCC#N)CC2=CC=CC=C2

InChI

InChI=1S/C19H19N3O3/c1-25-18(23)16-10-5-6-11-17(16)21-19(24)22(13-7-12-20)14-15-8-3-2-4-9-15/h2-6,8-11H,7,13-14H2,1H3,(H,21,24)