1-(5-methyl-3-nitro-2-oxidanyl-phenyl)-2-(4-methylphenyl)sulfanyl-ethanone

Systemtic Name: 1-(5-methyl-3-nitro-2-oxidanyl-phenyl)-2-(4-methylphenyl)sulfanyl-ethanone Openeye Name: 1-(2-hydroxy-5-methyl-3-nitro-phenyl)-2-(p-tolylsulfanyl)ethanone CAS Name: 1-(2-hydroxy-5-methyl-3-nitrophenyl)-2-[(4-methylphenyl)thio]ethanone IUPAC Name: 1-(2-hydroxy-5-methyl-3-nitrophenyl)-2-(4-methylphenyl)sulfanylethanone Traditional Name: 1-(2-hydroxy-5-methyl-3-nitro-phenyl)-2-(p-tolylthio)ethanone Formula: C16H15NO4S MolecularWeight: 317.3596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)C2=CC(=CC(=C2O)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)C2=CC(=CC(=C2O)[N+](=O)[O-])C

InChI

InChI=1S/C16H15NO4S/c1-10-3-5-12(6-4-10)22-9-15(18)13-7-11(2)8-14(16(13)19)17(20)21/h3-8,19H,9H2,1-2H3