4-[(2E)-2-[1-cyano-2-(ethoxycarbonylamino)-2-oxidanylidene-ethylidene]hydrazinyl]benzoate

Systemtic Name: 4-[(2E)-2-[1-cyano-2-(ethoxycarbonylamino)-2-oxidanylidene-ethylidene]hydrazinyl]benzoate Openeye Name: 4-[(2E)-2-[1-cyano-2-(ethoxycarbonylamino)-2-oxo-ethylidene]hydrazino]benzoate CAS Name: 4-[(2E)-2-[1-cyano-2-(ethoxycarbonylamino)-2-oxoethylidene]hydrazinyl]benzoate IUPAC Name: 4-[(2E)-2-[1-cyano-2-(ethoxycarbonylamino)-2-oxoethylidene]hydrazinyl]benzoate Traditional Name: 4-[(N'E)-N'-[2-(carbethoxyamino)-1-cyano-2-keto-ethylidene]hydrazino]benzoate Formula: C13H11N4O5- MolecularWeight: 303.25024

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=O)C(=NNC1=CC=C(C=C1)C(=O)[O-])C#N

Isomeric SMILES

CCOC(=O)NC(=O)/C(=N/NC1=CC=C(C=C1)C(=O)[O-])/C#N

InChI

InChI=1S/C13H12N4O5/c1-2-22-13(21)15-11(18)10(7-14)17-16-9-5-3-8(4-6-9)12(19)20/h3-6,16H,2H2,1H3,(H,19,20)(H,15,18,21)/p-1/b17-10+