1-(3-nitro-4-oxidanyl-phenyl)-2-phenylsulfanyl-ethanone

Systemtic Name: 1-(3-nitro-4-oxidanyl-phenyl)-2-phenylsulfanyl-ethanone Openeye Name: 1-(4-hydroxy-3-nitro-phenyl)-2-phenylsulfanyl-ethanone CAS Name: 1-(4-hydroxy-3-nitrophenyl)-2-(phenylthio)ethanone IUPAC Name: 1-(4-hydroxy-3-nitrophenyl)-2-phenylsulfanylethanone Traditional Name: 1-(4-hydroxy-3-nitro-phenyl)-2-(phenylthio)ethanone Formula: C14H11NO4S MolecularWeight: 289.30644

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11NO4S/c16-13-7-6-10(8-12(13)15(18)19)14(17)9-20-11-4-2-1-3-5-11/h1-8,16H,9H2