(4-nitrophenyl)methyl 4-ethanoylsulfanyl-2-methyl-3-naphthalen-2-yl-2-oxidanyl-pyrrolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 4-ethanoylsulfanyl-2-methyl-3-naphthalen-2-yl-2-oxidanyl-pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 4-acetylsulfanyl-2-hydroxy-2-methyl-3-(2-naphthyl)pyrrolidine-1-carboxylate CAS Name: 4-(acetylthio)-2-hydroxy-2-methyl-3-(2-naphthalenyl)-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 4-acetylsulfanyl-2-hydroxy-2-methyl-3-naphthalen-2-ylpyrrolidine-1-carboxylate Traditional Name: 4-(acetylthio)-2-hydroxy-2-methyl-3-(2-naphthyl)pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C25H24N2O6S MolecularWeight: 480.53286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC1CN(C(C1C2=CC3=CC=CC=C3C=C2)(C)O)C(=O)OCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC(=O)SC1CN(C(C1C2=CC3=CC=CC=C3C=C2)(C)O)C(=O)OCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H24N2O6S/c1-16(28)34-22-14-26(24(29)33-15-17-7-11-21(12-8-17)27(31)32)25(2,30)23(22)20-10-9-18-5-3-4-6-19(18)13-20/h3-13,22-23,30H,14-15H2,1-2H3