ethyl 4-(2-cyanoethanoylamino)benzoate

Systemtic Name: ethyl 4-(2-cyanoethanoylamino)benzoate Openeye Name: ethyl 4-[(2-cyanoacetyl)amino]benzoate CAS Name: 4-[(2-cyano-1-oxoethyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2-cyanoacetyl)amino]benzoate Traditional Name: 4-[(2-cyanoacetyl)amino]benzoic acid ethyl ester Formula: C12H12N2O3 MolecularWeight: 232.23528

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CC#N

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CC#N

InChI

InChI=1S/C12H12N2O3/c1-2-17-12(16)9-3-5-10(6-4-9)14-11(15)7-8-13/h3-6H,2,7H2,1H3,(H,14,15)