methyl 1-(4-tert-butylphenyl)carbonyl-5-[(4-fluorophenyl)methylcarbamoyl]-2-(4-methoxyphenyl)-4-phenyl-pyrrolidine-3-carboxylate

Systemtic Name: methyl 1-(4-tert-butylphenyl)carbonyl-5-[(4-fluorophenyl)methylcarbamoyl]-2-(4-methoxyphenyl)-4-phenyl-pyrrolidine-3-carboxylate Openeye Name: methyl 1-(4-tert-butylbenzoyl)-5-[(4-fluorophenyl)methylcarbamoyl]-2-(4-methoxyphenyl)-4-phenyl-pyrrolidine-3-carboxylate CAS Name: 1-[(4-tert-butylphenyl)-oxomethyl]-5-[[(4-fluorophenyl)methylamino]-oxomethyl]-2-(4-methoxyphenyl)-4-phenyl-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-tert-butylbenzoyl)-5-[(4-fluorophenyl)methylcarbamoyl]-2-(4-methoxyphenyl)-4-phenylpyrrolidine-3-carboxylate Traditional Name: 1-(4-tert-butylbenzoyl)-5-[(4-fluorobenzyl)carbamoyl]-2-(4-methoxyphenyl)-4-phenyl-pyrrolidine-3-carboxylic acid methyl ester Formula: C38H39FN2O5 MolecularWeight: 622.725063

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N2C(C(C(C2C(=O)NCC3=CC=C(C=C3)F)C4=CC=CC=C4)C(=O)OC)C5=CC=C(C=C5)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N2C(C(C(C2C(=O)NCC3=CC=C(C=C3)F)C4=CC=CC=C4)C(=O)OC)C5=CC=C(C=C5)OC

InChI

InChI=1S/C38H39FN2O5/c1-38(2,3)28-17-13-27(14-18-28)36(43)41-33(26-15-21-30(45-4)22-16-26)32(37(44)46-5)31(25-9-7-6-8-10-25)34(41)35(42)40-23-24-11-19-29(39)20-12-24/h6-22,31-34H,23H2,1-5H3,(H,40,42)