(4-nitrophenyl)methyl 5-oxidanylidene-2-phenylsulfanyl-oxolane-2-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 5-oxidanylidene-2-phenylsulfanyl-oxolane-2-carboxylate Openeye Name: (4-nitrophenyl)methyl 5-oxo-2-phenylsulfanyl-tetrahydrofuran-2-carboxylate CAS Name: 5-oxo-2-(phenylthio)-2-oxolanecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 5-oxo-2-phenylsulfanyloxolane-2-carboxylate Traditional Name: 5-keto-2-(phenylthio)tetrahydrofuran-2-carboxylic acid (4-nitrobenzyl) ester Formula: C18H15NO6S MolecularWeight: 373.3798

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1=O)(C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])SC3=CC=CC=C3

Isomeric SMILES

C1CC(OC1=O)(C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])SC3=CC=CC=C3

InChI

InChI=1S/C18H15NO6S/c20-16-10-11-18(25-16,26-15-4-2-1-3-5-15)17(21)24-12-13-6-8-14(9-7-13)19(22)23/h1-9H,10-12H2