(2-methoxy-2-oxidanylidene-ethyl)sulfanyl 3-nitrobenzoate

Systemtic Name: (2-methoxy-2-oxidanylidene-ethyl)sulfanyl 3-nitrobenzoate Openeye Name: (2-methoxy-2-oxo-ethyl)sulfanyl 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [(2-methoxy-2-oxoethyl)thio] ester IUPAC Name: (2-methoxy-2-oxoethyl)sulfanyl 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [(2-keto-2-methoxy-ethyl)thio] ester Formula: C10H9NO6S MolecularWeight: 271.24656

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSOC(=O)C1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CSOC(=O)C1=CC(=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C10H9NO6S/c1-16-9(12)6-18-17-10(13)7-3-2-4-8(5-7)11(14)15/h2-5H,6H2,1H3