[4-[(2-cyanoethanoylamino)carbamoyl]phenyl] ethanoate

Systemtic Name: [4-[(2-cyanoethanoylamino)carbamoyl]phenyl] ethanoate Openeye Name: [4-[[(2-cyanoacetyl)amino]carbamoyl]phenyl] acetate CAS Name: acetic acid [4-[[(2-cyano-1-oxoethyl)hydrazo]-oxomethyl]phenyl] ester IUPAC Name: [4-[[(2-cyanoacetyl)amino]carbamoyl]phenyl] acetate Traditional Name: acetic acid [4-[[(2-cyanoacetyl)amino]carbamoyl]phenyl] ester Formula: C12H11N3O4 MolecularWeight: 261.23344

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)C(=O)NNC(=O)CC#N

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)C(=O)NNC(=O)CC#N

InChI

InChI=1S/C12H11N3O4/c1-8(16)19-10-4-2-9(3-5-10)12(18)15-14-11(17)6-7-13/h2-5H,6H2,1H3,(H,14,17)(H,15,18)