ethyl 4-[(2-cyanoethanoylamino)carbamoylamino]benzoate

Systemtic Name: ethyl 4-[(2-cyanoethanoylamino)carbamoylamino]benzoate Openeye Name: ethyl 4-[[(2-cyanoacetyl)amino]carbamoylamino]benzoate CAS Name: 4-[[[(2-cyano-1-oxoethyl)hydrazo]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(2-cyanoacetyl)amino]carbamoylamino]benzoate Traditional Name: 4-[[(2-cyanoacetyl)amino]carbamoylamino]benzoic acid ethyl ester Formula: C13H14N4O4 MolecularWeight: 290.27466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N4O4/c1-2-21-12(19)9-3-5-10(6-4-9)15-13(20)17-16-11(18)7-8-14/h3-6H,2,7H2,1H3,(H,16,18)(H2,15,17,20)