methyl 2-(4-cyanophenyl)-1-(3-cyclopentylpropanoyl)-5-[(4-methylphenyl)methylcarbamoyl]-4-phenyl-pyrrolidine-3-carboxylate

Systemtic Name: methyl 2-(4-cyanophenyl)-1-(3-cyclopentylpropanoyl)-5-[(4-methylphenyl)methylcarbamoyl]-4-phenyl-pyrrolidine-3-carboxylate Openeye Name: methyl 2-(4-cyanophenyl)-1-(3-cyclopentylpropanoyl)-4-phenyl-5-(p-tolylmethylcarbamoyl)pyrrolidine-3-carboxylate CAS Name: 2-(4-cyanophenyl)-1-(3-cyclopentyl-1-oxopropyl)-5-[[(4-methylphenyl)methylamino]-oxomethyl]-4-phenyl-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-cyanophenyl)-1-(3-cyclopentylpropanoyl)-5-[(4-methylphenyl)methylcarbamoyl]-4-phenylpyrrolidine-3-carboxylate Traditional Name: 2-(4-cyanophenyl)-1-(3-cyclopentylpropanoyl)-5-[(4-methylbenzyl)carbamoyl]-4-phenyl-pyrrolidine-3-carboxylic acid methyl ester Formula: C36H39N3O4 MolecularWeight: 577.71256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2C(C(C(N2C(=O)CCC3CCCC3)C4=CC=C(C=C4)C#N)C(=O)OC)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2C(C(C(N2C(=O)CCC3CCCC3)C4=CC=C(C=C4)C#N)C(=O)OC)C5=CC=CC=C5

InChI

InChI=1S/C36H39N3O4/c1-24-12-14-27(15-13-24)23-38-35(41)34-31(28-10-4-3-5-11-28)32(36(42)43-2)33(29-19-16-26(22-37)17-20-29)39(34)30(40)21-18-25-8-6-7-9-25/h3-5,10-17,19-20,25,31-34H,6-9,18,21,23H2,1-2H3,(H,38,41)