(4-nitrophenyl)methyl 2-[4-(acetyloxymethyl)-1,3-dioxolan-2-yl]-4-ethanoylsulfanyl-pyrrolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 2-[4-(acetyloxymethyl)-1,3-dioxolan-2-yl]-4-ethanoylsulfanyl-pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 2-[4-(acetoxymethyl)-1,3-dioxolan-2-yl]-4-acetylsulfanyl-pyrrolidine-1-carboxylate CAS Name: 2-[4-(acetyloxymethyl)-1,3-dioxolan-2-yl]-4-(acetylthio)-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-[4-(acetyloxymethyl)-1,3-dioxolan-2-yl]-4-acetylsulfanylpyrrolidine-1-carboxylate Traditional Name: 2-[4-(acetoxymethyl)-1,3-dioxolan-2-yl]-4-(acetylthio)pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C20H24N2O9S MolecularWeight: 468.47756

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1COC(O1)C2CC(CN2C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])SC(=O)C

Isomeric SMILES

CC(=O)OCC1COC(O1)C2CC(CN2C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])SC(=O)C

InChI

InChI=1S/C20H24N2O9S/c1-12(23)28-10-16-11-29-19(31-16)18-7-17(32-13(2)24)8-21(18)20(25)30-9-14-3-5-15(6-4-14)22(26)27/h3-6,16-19H,7-11H2,1-2H3