(1E,4E)-1-methylsulfanyl-5-(4-nitrophenyl)-1-oxidanyl-penta-1,4-dien-3-one

Systemtic Name: (1E,4E)-1-methylsulfanyl-5-(4-nitrophenyl)-1-oxidanyl-penta-1,4-dien-3-one Openeye Name: (1E,4E)-1-hydroxy-1-methylsulfanyl-5-(4-nitrophenyl)penta-1,4-dien-3-one CAS Name: (1E,4E)-1-hydroxy-1-(methylthio)-5-(4-nitrophenyl)-3-penta-1,4-dienone IUPAC Name: (1E,4E)-1-hydroxy-1-methylsulfanyl-5-(4-nitrophenyl)penta-1,4-dien-3-one Traditional Name: (1E,4E)-1-hydroxy-1-(methylthio)-5-(4-nitrophenyl)penta-1,4-dien-3-one Formula: C12H11NO4S MolecularWeight: 265.28504

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=CC(=O)C=CC1=CC=C(C=C1)[N+](=O)[O-])O

Isomeric SMILES

CS/C(=C/C(=O)/C=C/C1=CC=C(C=C1)[N+](=O)[O-])/O

InChI

InChI=1S/C12H11NO4S/c1-18-12(15)8-11(14)7-4-9-2-5-10(6-3-9)13(16)17/h2-8,15H,1H3/b7-4+,12-8+