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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1COC(=O)C2=CC=C(C=C2)NC(=O)CC#N

Isomeric SMILES

CC1=CC=CC=C1COC(=O)C2=CC=C(C=C2)NC(=O)CC#N

InChI

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