[2-[2-cyanoethyl-(4-methylphenyl)amino]-2-oxidanylidene-ethyl] 4-oxidanylidene-2-phenylazanyl-furan-3-carboxylate

Systemtic Name: [2-[2-cyanoethyl-(4-methylphenyl)amino]-2-oxidanylidene-ethyl] 4-oxidanylidene-2-phenylazanyl-furan-3-carboxylate Openeye Name: [2-[N-(2-cyanoethyl)-4-methyl-anilino]-2-oxo-ethyl] 2-anilino-4-oxo-furan-3-carboxylate CAS Name: 2-anilino-4-oxo-3-furancarboxylic acid [2-[N-(2-cyanoethyl)-4-methylanilino]-2-oxoethyl] ester IUPAC Name: [2-[N-(2-cyanoethyl)-4-methylanilino]-2-oxoethyl] 2-anilino-4-oxofuran-3-carboxylate Traditional Name: 2-anilino-4-keto-furan-3-carboxylic acid [2-[N-(2-cyanoethyl)-4-methyl-anilino]-2-keto-ethyl] ester Formula: C23H21N3O5 MolecularWeight: 419.42994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CCC#N)C(=O)COC(=O)C2=C(OCC2=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)N(CCC#N)C(=O)COC(=O)C2=C(OCC2=O)NC3=CC=CC=C3

InChI

InChI=1S/C23H21N3O5/c1-16-8-10-18(11-9-16)26(13-5-12-24)20(28)15-31-23(29)21-19(27)14-30-22(21)25-17-6-3-2-4-7-17/h2-4,6-11,25H,5,13-15H2,1H3