[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 4-oxidanylidene-2-phenylazanyl-furan-3-carboxylate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 4-oxidanylidene-2-phenylazanyl-furan-3-carboxylate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] 2-anilino-4-oxo-furan-3-carboxylate CAS Name: 2-anilino-4-oxo-3-furancarboxylic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 2-anilino-4-oxofuran-3-carboxylate Traditional Name: 2-anilino-4-keto-furan-3-carboxylic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C16H15N3O5 MolecularWeight: 329.3074

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C(=C(O1)NC2=CC=CC=C2)C(=O)OCC(=O)NCCC#N

Isomeric SMILES

C1C(=O)C(=C(O1)NC2=CC=CC=C2)C(=O)OCC(=O)NCCC#N

InChI

InChI=1S/C16H15N3O5/c17-7-4-8-18-13(21)10-24-16(22)14-12(20)9-23-15(14)19-11-5-2-1-3-6-11/h1-3,5-6,19H,4,8-10H2,(H,18,21)