2-[2-(3-nitrophenyl)-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: 2-[2-(3-nitrophenyl)-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: 2-[2-(3-nitrophenyl)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-(3-nitrophenyl)-2-oxoethyl]thio]benzoate IUPAC Name: 2-[2-(3-nitrophenyl)-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-keto-2-(3-nitrophenyl)ethyl]thio]benzoate Formula: C15H10NO5S- MolecularWeight: 316.3086

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)[O-])SCC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)[O-])SCC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H11NO5S/c17-13(10-4-3-5-11(8-10)16(20)21)9-22-14-7-2-1-6-12(14)15(18)19/h1-8H,9H2,(H,18,19)/p-1