(4-nitrophenyl)methyl 2-(2-aminocarbonylpyrrolidin-1-yl)-2-methyl-4-(triphenylmethyl)sulfanyl-pyrrolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 2-(2-aminocarbonylpyrrolidin-1-yl)-2-methyl-4-(triphenylmethyl)sulfanyl-pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 2-(2-carbamoylpyrrolidin-1-yl)-2-methyl-4-tritylsulfanyl-pyrrolidine-1-carboxylate CAS Name: 2-(2-carbamoyl-1-pyrrolidinyl)-2-methyl-4-[(triphenylmethyl)thio]-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-(2-carbamoylpyrrolidin-1-yl)-2-methyl-4-tritylsulfanylpyrrolidine-1-carboxylate Traditional Name: 2-(2-carbamoylpyrrolidino)-2-methyl-4-(tritylthio)pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C37H38N4O5S MolecularWeight: 650.78642

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CN1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])SC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)N6CCCC6C(=O)N

Isomeric SMILES

CC1(CC(CN1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])SC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)N6CCCC6C(=O)N

InChI

InChI=1S/C37H38N4O5S/c1-36(39-23-11-18-33(39)34(38)42)24-32(25-40(36)35(43)46-26-27-19-21-31(22-20-27)41(44)45)47-37(28-12-5-2-6-13-28,29-14-7-3-8-15-29)30-16-9-4-10-17-30/h2-10,12-17,19-22,32-33H,11,18,23-26H2,1H3,(H2,38,42)