4-(2-cyanoethanoylamino)benzoic acid

Systemtic Name: 4-(2-cyanoethanoylamino)benzoic acid Openeye Name: 4-[(2-cyanoacetyl)amino]benzoic acid CAS Name: 4-[(2-cyano-1-oxoethyl)amino]benzoic acid IUPAC Name: 4-[(2-cyanoacetyl)amino]benzoic acid Traditional Name: 4-[(2-cyanoacetyl)amino]benzoic acid Formula: C10H8N2O3 MolecularWeight: 204.18212

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NC(=O)CC#N

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NC(=O)CC#N

InChI

InChI=1S/C10H8N2O3/c11-6-5-9(13)12-8-3-1-7(2-4-8)10(14)15/h1-4H,5H2,(H,12,13)(H,14,15)