S-[2-(3-nitrophenyl)-2-oxidanylidene-ethyl] ethanethioate

Systemtic Name: S-[2-(3-nitrophenyl)-2-oxidanylidene-ethyl] ethanethioate Openeye Name: S-[2-(3-nitrophenyl)-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-(3-nitrophenyl)-2-oxoethyl] ester IUPAC Name: S-[2-(3-nitrophenyl)-2-oxoethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-keto-2-(3-nitrophenyl)ethyl] ester Formula: C10H9NO4S MolecularWeight: 239.24776

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(=O)C1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

CC(=O)SCC(=O)C1=CC(=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C10H9NO4S/c1-7(12)16-6-10(13)8-3-2-4-9(5-8)11(14)15/h2-5H,6H2,1H3