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

Systemtic Name: (4-nitrophenyl)methyl 2-(phenylsulfanylmethyl)-4-(triphenylmethyl)sulfanyl-pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 2-(phenylsulfanylmethyl)-4-tritylsulfanyl-pyrrolidine-1-carboxylate CAS Name: 2-[(phenylthio)methyl]-4-[(triphenylmethyl)thio]-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-(phenylsulfanylmethyl)-4-tritylsulfanylpyrrolidine-1-carboxylate Traditional Name: 2-[(phenylthio)methyl]-4-(tritylthio)pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C38H34N2O4S2 MolecularWeight: 646.81756

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1CSC2=CC=CC=C2)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])SC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1C(CN(C1CSC2=CC=CC=C2)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])SC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C38H34N2O4S2/c41-37(44-27-29-21-23-33(24-22-29)40(42)43)39-26-36(25-34(39)28-45-35-19-11-4-12-20-35)46-38(30-13-5-1-6-14-30,31-15-7-2-8-16-31)32-17-9-3-10-18-32/h1-24,34,36H,25-28H2