[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl] 4-[(2-ethylphenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: [2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl] 4-[(2-ethylphenyl)amino]-4-oxidanylidene-butanoate Openeye Name: [2-(3,4-dimethylphenyl)-2-oxo-ethyl] 4-(2-ethylanilino)-4-oxo-butanoate CAS Name: 4-(2-ethylanilino)-4-oxobutanoic acid [2-(3,4-dimethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethylphenyl)-2-oxoethyl] 4-(2-ethylanilino)-4-oxobutanoate Traditional Name: 4-(2-ethylanilino)-4-keto-butyric acid [2-(3,4-dimethylphenyl)-2-keto-ethyl] ester Formula: C22H25NO4 MolecularWeight: 367.4382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CCC(=O)OCC(=O)C2=CC(=C(C=C2)C)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CCC(=O)OCC(=O)C2=CC(=C(C=C2)C)C

InChI

InChI=1S/C22H25NO4/c1-4-17-7-5-6-8-19(17)23-21(25)11-12-22(26)27-14-20(24)18-10-9-15(2)16(3)13-18/h5-10,13H,4,11-12,14H2,1-3H3,(H,23,25)