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

Systemtic Name: (4-nitrophenyl)methyl 2-(2-chloranylethanoylamino)-2-methyl-4-(triphenylmethyl)sulfanyl-pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 2-[(2-chloroacetyl)amino]-2-methyl-4-tritylsulfanyl-pyrrolidine-1-carboxylate CAS Name: 2-[(2-chloro-1-oxoethyl)amino]-2-methyl-4-[(triphenylmethyl)thio]-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-[(2-chloroacetyl)amino]-2-methyl-4-tritylsulfanylpyrrolidine-1-carboxylate Traditional Name: 2-[(2-chloroacetyl)amino]-2-methyl-4-(tritylthio)pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C34H32ClN3O5S MolecularWeight: 630.15298

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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)NC(=O)CCl

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)NC(=O)CCl

InChI

InChI=1S/C34H32ClN3O5S/c1-33(36-31(39)22-35)21-30(23-37(33)32(40)43-24-25-17-19-29(20-18-25)38(41)42)44-34(26-11-5-2-6-12-26,27-13-7-3-8-14-27)28-15-9-4-10-16-28/h2-20,30H,21-24H2,1H3,(H,36,39)