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

Systemtic Name: [2-(4-methylphenyl)-2-oxidanylidene-ethyl] (3S)-1-[4-(4-methoxyphenoxy)phenyl]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-oxo-2-(p-tolyl)ethyl] (3S)-1-[4-(4-methoxyphenoxy)phenyl]-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-[4-(4-methoxyphenoxy)phenyl]-5-oxo-3-pyrrolidinecarboxylic acid [2-(4-methylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methylphenyl)-2-oxoethyl] (3S)-1-[4-(4-methoxyphenoxy)phenyl]-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-5-keto-1-[4-(4-methoxyphenoxy)phenyl]pyrrolidine-3-carboxylic acid [2-keto-2-(p-tolyl)ethyl] ester Formula: C27H25NO6 MolecularWeight: 459.4905

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)COC(=O)C2CC(=O)N(C2)C3=CC=C(C=C3)OC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)COC(=O)[C@H]2CC(=O)N(C2)C3=CC=C(C=C3)OC4=CC=C(C=C4)OC

InChI

InChI=1S/C27H25NO6/c1-18-3-5-19(6-4-18)25(29)17-33-27(31)20-15-26(30)28(16-20)21-7-9-23(10-8-21)34-24-13-11-22(32-2)12-14-24/h3-14,20H,15-17H2,1-2H3/t20-/m0/s1