[(2S)-1-[(4-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 4-(3,4-dimethylphenyl)-4-oxidanylidene-butanoate

Systemtic Name: [(2S)-1-[(4-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 4-(3,4-dimethylphenyl)-4-oxidanylidene-butanoate Openeye Name: [(1S)-1-methyl-2-(4-methylanilino)-2-oxo-ethyl] 4-(3,4-dimethylphenyl)-4-oxo-butanoate CAS Name: 4-(3,4-dimethylphenyl)-4-oxobutanoic acid [(2S)-1-(4-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-methylanilino)-1-oxopropan-2-yl] 4-(3,4-dimethylphenyl)-4-oxobutanoate Traditional Name: 4-(3,4-dimethylphenyl)-4-keto-butyric acid [(1S)-2-keto-1-methyl-2-(p-toluidino)ethyl] ester Formula: C22H25NO4 MolecularWeight: 367.4382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(C)OC(=O)CCC(=O)C2=CC(=C(C=C2)C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)[C@H](C)OC(=O)CCC(=O)C2=CC(=C(C=C2)C)C

InChI

InChI=1S/C22H25NO4/c1-14-5-9-19(10-6-14)23-22(26)17(4)27-21(25)12-11-20(24)18-8-7-15(2)16(3)13-18/h5-10,13,17H,11-12H2,1-4H3,(H,23,26)/t17-/m0/s1