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

Systemtic Name: methyl 2-(4-tert-butylphenyl)-5-[(4-methoxyphenyl)methylcarbamoyl]-1-methylsulfonyl-pyrrolidine-3-carboxylate Openeye Name: methyl 2-(4-tert-butylphenyl)-5-[(4-methoxyphenyl)methylcarbamoyl]-1-methylsulfonyl-pyrrolidine-3-carboxylate CAS Name: 2-(4-tert-butylphenyl)-5-[[(4-methoxyphenyl)methylamino]-oxomethyl]-1-methylsulfonyl-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-tert-butylphenyl)-5-[(4-methoxyphenyl)methylcarbamoyl]-1-methylsulfonylpyrrolidine-3-carboxylate Traditional Name: 2-(4-tert-butylphenyl)-1-mesyl-5-(p-anisylcarbamoyl)pyrrolidine-3-carboxylic acid methyl ester Formula: C26H34N2O6S MolecularWeight: 502.62296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2C(CC(N2S(=O)(=O)C)C(=O)NCC3=CC=C(C=C3)OC)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2C(CC(N2S(=O)(=O)C)C(=O)NCC3=CC=C(C=C3)OC)C(=O)OC

InChI

InChI=1S/C26H34N2O6S/c1-26(2,3)19-11-9-18(10-12-19)23-21(25(30)34-5)15-22(28(23)35(6,31)32)24(29)27-16-17-7-13-20(33-4)14-8-17/h7-14,21-23H,15-16H2,1-6H3,(H,27,29)