methyl 4-[2-cyanoethyl-(phenylmethyl)carbamoyl]benzoate

Systemtic Name: methyl 4-[2-cyanoethyl-(phenylmethyl)carbamoyl]benzoate Openeye Name: methyl 4-[benzyl(2-cyanoethyl)carbamoyl]benzoate CAS Name: 4-[[2-cyanoethyl-(phenylmethyl)amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[benzyl(2-cyanoethyl)carbamoyl]benzoate Traditional Name: 4-[benzyl(2-cyanoethyl)carbamoyl]benzoic acid methyl ester Formula: C19H18N2O3 MolecularWeight: 322.35782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18N2O3/c1-24-19(23)17-10-8-16(9-11-17)18(22)21(13-5-12-20)14-15-6-3-2-4-7-15/h2-4,6-11H,5,13-14H2,1H3