5-(4-chlorophenyl)-N-[(4-methoxyphenyl)methyl]-1-methylsulfonyl-3-(4-nitrophenyl)-4-(phenylcarbonyl)pyrrolidine-2-carboxamide

Systemtic Name: 5-(4-chlorophenyl)-N-[(4-methoxyphenyl)methyl]-1-methylsulfonyl-3-(4-nitrophenyl)-4-(phenylcarbonyl)pyrrolidine-2-carboxamide Openeye Name: 4-benzoyl-5-(4-chlorophenyl)-N-[(4-methoxyphenyl)methyl]-1-methylsulfonyl-3-(4-nitrophenyl)pyrrolidine-2-carboxamide CAS Name: 4-benzoyl-5-(4-chlorophenyl)-N-[(4-methoxyphenyl)methyl]-1-methylsulfonyl-3-(4-nitrophenyl)-2-pyrrolidinecarboxamide IUPAC Name: 4-benzoyl-5-(4-chlorophenyl)-N-[(4-methoxyphenyl)methyl]-1-methylsulfonyl-3-(4-nitrophenyl)pyrrolidine-2-carboxamide Traditional Name: 4-benzoyl-5-(4-chlorophenyl)-1-mesyl-3-(4-nitrophenyl)-N-p-anisyl-pyrrolidine-2-carboxamide Formula: C33H30ClN3O7S MolecularWeight: 648.1252

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)C2C(C(C(N2S(=O)(=O)C)C3=CC=C(C=C3)Cl)C(=O)C4=CC=CC=C4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)C2C(C(C(N2S(=O)(=O)C)C3=CC=C(C=C3)Cl)C(=O)C4=CC=CC=C4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C33H30ClN3O7S/c1-44-27-18-8-21(9-19-27)20-35-33(39)31-28(22-12-16-26(17-13-22)37(40)41)29(32(38)24-6-4-3-5-7-24)30(36(31)45(2,42)43)23-10-14-25(34)15-11-23/h3-19,28-31H,20H2,1-2H3,(H,35,39)