[2-[(2-cyano-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] (2E,4E)-hexa-2,4-dienoate

Systemtic Name: [2-[(2-cyano-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] (2E,4E)-hexa-2,4-dienoate Openeye Name: [2-(2-cyano-4-nitro-anilino)-2-oxo-ethyl] (2E,4E)-hexa-2,4-dienoate CAS Name: (2E,4E)-hexa-2,4-dienoic acid [2-(2-cyano-4-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyano-4-nitroanilino)-2-oxoethyl] (2E,4E)-hexa-2,4-dienoate Traditional Name: (2E,4E)-hexa-2,4-dienoic acid [2-(2-cyano-4-nitro-anilino)-2-keto-ethyl] ester Formula: C15H13N3O5 MolecularWeight: 315.28082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=CC=CC(=O)OCC(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])C#N

Isomeric SMILES

C/C=C/C=C/C(=O)OCC(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])C#N

InChI

InChI=1S/C15H13N3O5/c1-2-3-4-5-15(20)23-10-14(19)17-13-7-6-12(18(21)22)8-11(13)9-16/h2-8H,10H2,1H3,(H,17,19)/b3-2+,5-4+