[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl] (3S)-1-(4-butylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl] (3S)-1-(4-butylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(4-methylanilino)-2-oxo-ethyl] (3S)-1-(4-butylphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(4-butylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid [2-(4-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-methylanilino)-2-oxoethyl] (3S)-1-(4-butylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(4-butylphenyl)-5-keto-pyrrolidine-3-carboxylic acid [2-keto-2-(p-toluidino)ethyl] ester Formula: C24H28N2O4 MolecularWeight: 408.49012

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2CC(CC2=O)C(=O)OCC(=O)NC3=CC=C(C=C3)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C[C@H](CC2=O)C(=O)OCC(=O)NC3=CC=C(C=C3)C

InChI

InChI=1S/C24H28N2O4/c1-3-4-5-18-8-12-21(13-9-18)26-15-19(14-23(26)28)24(29)30-16-22(27)25-20-10-6-17(2)7-11-20/h6-13,19H,3-5,14-16H2,1-2H3,(H,25,27)/t19-/m0/s1