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

Systemtic Name: methyl 2-(4-cyanophenyl)-5-[(4-methylphenyl)methylcarbamoyl]-1-pyridin-3-ylcarbonyl-pyrrolidine-3-carboxylate Openeye Name: methyl 2-(4-cyanophenyl)-5-(p-tolylmethylcarbamoyl)-1-(pyridine-3-carbonyl)pyrrolidine-3-carboxylate CAS Name: 2-(4-cyanophenyl)-5-[[(4-methylphenyl)methylamino]-oxomethyl]-1-[oxo(3-pyridinyl)methyl]-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-cyanophenyl)-5-[(4-methylphenyl)methylcarbamoyl]-1-(pyridine-3-carbonyl)pyrrolidine-3-carboxylate Traditional Name: 2-(4-cyanophenyl)-5-[(4-methylbenzyl)carbamoyl]-1-nicotinoyl-pyrrolidine-3-carboxylic acid methyl ester Formula: C28H26N4O4 MolecularWeight: 482.53044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2CC(C(N2C(=O)C3=CN=CC=C3)C4=CC=C(C=C4)C#N)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2CC(C(N2C(=O)C3=CN=CC=C3)C4=CC=C(C=C4)C#N)C(=O)OC

InChI

InChI=1S/C28H26N4O4/c1-18-5-7-20(8-6-18)16-31-26(33)24-14-23(28(35)36-2)25(21-11-9-19(15-29)10-12-21)32(24)27(34)22-4-3-13-30-17-22/h3-13,17,23-25H,14,16H2,1-2H3,(H,31,33)