[(3S)-2-oxidanylideneoxolan-3-yl] 2-(4-chlorophenyl)sulfanyl-5-nitro-benzoate

Systemtic Name: [(3S)-2-oxidanylideneoxolan-3-yl] 2-(4-chlorophenyl)sulfanyl-5-nitro-benzoate Openeye Name: [(3S)-2-oxotetrahydrofuran-3-yl] 2-(4-chlorophenyl)sulfanyl-5-nitro-benzoate CAS Name: 2-[(4-chlorophenyl)thio]-5-nitrobenzoic acid [(3S)-2-oxo-3-oxolanyl] ester IUPAC Name: [(3S)-2-oxooxolan-3-yl] 2-(4-chlorophenyl)sulfanyl-5-nitrobenzoate Traditional Name: 2-[(4-chlorophenyl)thio]-5-nitro-benzoic acid [(3S)-2-ketotetrahydrofuran-3-yl] ester Formula: C17H12ClNO6S MolecularWeight: 393.79828

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(=O)C1OC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])SC3=CC=C(C=C3)Cl

Isomeric SMILES

C1COC(=O)[C@H]1OC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H12ClNO6S/c18-10-1-4-12(5-2-10)26-15-6-3-11(19(22)23)9-13(15)16(20)25-14-7-8-24-17(14)21/h1-6,9,14H,7-8H2/t14-/m0/s1