[2-[(2-cyano-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-[(3,4-diethoxyphenyl)carbonylamino]ethanoate

Systemtic Name: [2-[(2-cyano-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-[(3,4-diethoxyphenyl)carbonylamino]ethanoate Openeye Name: [2-(2-cyano-4-nitro-anilino)-2-oxo-ethyl] 2-[(3,4-diethoxybenzoyl)amino]acetate CAS Name: 2-[[(3,4-diethoxyphenyl)-oxomethyl]amino]acetic acid [2-(2-cyano-4-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyano-4-nitroanilino)-2-oxoethyl] 2-[(3,4-diethoxybenzoyl)amino]acetate Traditional Name: 2-[(3,4-diethoxybenzoyl)amino]acetic acid [2-(2-cyano-4-nitro-anilino)-2-keto-ethyl] ester Formula: C22H22N4O8 MolecularWeight: 470.43208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NCC(=O)OCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C#N)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NCC(=O)OCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C#N)OCC

InChI

InChI=1S/C22H22N4O8/c1-3-32-18-8-5-14(10-19(18)33-4-2)22(29)24-12-21(28)34-13-20(27)25-17-7-6-16(26(30)31)9-15(17)11-23/h5-10H,3-4,12-13H2,1-2H3,(H,24,29)(H,25,27)