(3-methylphenyl)methyl 4-(2-cyanoethanoylamino)benzoate

Systemtic Name: (3-methylphenyl)methyl 4-(2-cyanoethanoylamino)benzoate Openeye Name: m-tolylmethyl 4-[(2-cyanoacetyl)amino]benzoate CAS Name: 4-[(2-cyano-1-oxoethyl)amino]benzoic acid (3-methylphenyl)methyl ester IUPAC Name: (3-methylphenyl)methyl 4-[(2-cyanoacetyl)amino]benzoate Traditional Name: 4-[(2-cyanoacetyl)amino]benzoic acid (3-methylbenzyl) ester Formula: C18H16N2O3 MolecularWeight: 308.33124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)COC(=O)C2=CC=C(C=C2)NC(=O)CC#N

Isomeric SMILES

CC1=CC(=CC=C1)COC(=O)C2=CC=C(C=C2)NC(=O)CC#N

InChI

InChI=1S/C18H16N2O3/c1-13-3-2-4-14(11-13)12-23-18(22)15-5-7-16(8-6-15)20-17(21)9-10-19/h2-8,11H,9,12H2,1H3,(H,20,21)