2-(4-methoxyphenyl)sulfanyl-1-[3-nitro-4,5-bis(oxidanyl)phenyl]ethanone

Systemtic Name: 2-(4-methoxyphenyl)sulfanyl-1-[3-nitro-4,5-bis(oxidanyl)phenyl]ethanone Openeye Name: 1-(3,4-dihydroxy-5-nitro-phenyl)-2-(4-methoxyphenyl)sulfanyl-ethanone CAS Name: 1-(3,4-dihydroxy-5-nitrophenyl)-2-[(4-methoxyphenyl)thio]ethanone IUPAC Name: 1-(3,4-dihydroxy-5-nitrophenyl)-2-(4-methoxyphenyl)sulfanylethanone Traditional Name: 1-(3,4-dihydroxy-5-nitro-phenyl)-2-[(4-methoxyphenyl)thio]ethanone Formula: C15H13NO6S MolecularWeight: 335.33182

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SCC(=O)C2=CC(=C(C(=C2)O)O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)SCC(=O)C2=CC(=C(C(=C2)O)O)[N+](=O)[O-]

InChI

InChI=1S/C15H13NO6S/c1-22-10-2-4-11(5-3-10)23-8-14(18)9-6-12(16(20)21)15(19)13(17)7-9/h2-7,17,19H,8H2,1H3