(2-methoxy-2-oxidanylidene-ethyl) 4-(2-cyanoethanoylamino)benzoate

Systemtic Name: (2-methoxy-2-oxidanylidene-ethyl) 4-(2-cyanoethanoylamino)benzoate Openeye Name: (2-methoxy-2-oxo-ethyl) 4-[(2-cyanoacetyl)amino]benzoate CAS Name: 4-[(2-cyano-1-oxoethyl)amino]benzoic acid (2-methoxy-2-oxoethyl) ester IUPAC Name: (2-methoxy-2-oxoethyl) 4-[(2-cyanoacetyl)amino]benzoate Traditional Name: 4-[(2-cyanoacetyl)amino]benzoic acid (2-keto-2-methoxy-ethyl) ester Formula: C13H12N2O5 MolecularWeight: 276.24478

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12N2O5/c1-19-12(17)8-20-13(18)9-2-4-10(5-3-9)15-11(16)6-7-14/h2-5H,6,8H2,1H3,(H,15,16)