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

Systemtic Name: [2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl] (3S)-5-oxidanylidene-1-(4-propoxyphenyl)pyrrolidine-3-carboxylate Openeye Name: [2-(2-methylanilino)-2-oxo-ethyl] (3S)-5-oxo-1-(4-propoxyphenyl)pyrrolidine-3-carboxylate CAS Name: (3S)-5-oxo-1-(4-propoxyphenyl)-3-pyrrolidinecarboxylic acid [2-(2-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylanilino)-2-oxoethyl] (3S)-5-oxo-1-(4-propoxyphenyl)pyrrolidine-3-carboxylate Traditional Name: (3S)-5-keto-1-(4-propoxyphenyl)pyrrolidine-3-carboxylic acid [2-keto-2-(o-toluidino)ethyl] ester Formula: C23H26N2O5 MolecularWeight: 410.46294

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)N2CC(CC2=O)C(=O)OCC(=O)NC3=CC=CC=C3C

Isomeric SMILES

CCCOC1=CC=C(C=C1)N2C[C@H](CC2=O)C(=O)OCC(=O)NC3=CC=CC=C3C

InChI

InChI=1S/C23H26N2O5/c1-3-12-29-19-10-8-18(9-11-19)25-14-17(13-22(25)27)23(28)30-15-21(26)24-20-7-5-4-6-16(20)2/h4-11,17H,3,12-15H2,1-2H3,(H,24,26)/t17-/m0/s1