(4-nitrophenyl)methyl 3-(triphenylmethyl)sulfanylpyrrolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 3-(triphenylmethyl)sulfanylpyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 3-tritylsulfanylpyrrolidine-1-carboxylate CAS Name: 3-[(triphenylmethyl)thio]-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3-tritylsulfanylpyrrolidine-1-carboxylate Traditional Name: 3-(tritylthio)pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C31H28N2O4S MolecularWeight: 524.63002

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1SC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OCC5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC1SC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OCC5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C31H28N2O4S/c34-30(37-23-24-16-18-28(19-17-24)33(35)36)32-21-20-29(22-32)38-31(25-10-4-1-5-11-25,26-12-6-2-7-13-26)27-14-8-3-9-15-27/h1-19,29H,20-23H2