methyl 1-(4-methylphenyl)carbonyl-5-(phenethylcarbamoyl)-2,4-diphenyl-pyrrolidine-3-carboxylate

Systemtic Name: methyl 1-(4-methylphenyl)carbonyl-5-(phenethylcarbamoyl)-2,4-diphenyl-pyrrolidine-3-carboxylate Openeye Name: methyl 1-(4-methylbenzoyl)-5-(phenethylcarbamoyl)-2,4-diphenyl-pyrrolidine-3-carboxylate CAS Name: 1-[(4-methylphenyl)-oxomethyl]-5-[oxo-(phenethylamino)methyl]-2,4-diphenyl-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-methylbenzoyl)-5-(phenethylcarbamoyl)-2,4-diphenylpyrrolidine-3-carboxylate Traditional Name: 5-(phenethylcarbamoyl)-2,4-diphenyl-1-p-toluoyl-pyrrolidine-3-carboxylic acid methyl ester Formula: C35H34N2O4 MolecularWeight: 546.65546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2C(C(C(C2C(=O)NCCC3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2C(C(C(C2C(=O)NCCC3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC)C5=CC=CC=C5

InChI

InChI=1S/C35H34N2O4/c1-24-18-20-28(21-19-24)34(39)37-31(27-16-10-5-11-17-27)30(35(40)41-2)29(26-14-8-4-9-15-26)32(37)33(38)36-23-22-25-12-6-3-7-13-25/h3-21,29-32H,22-23H2,1-2H3,(H,36,38)