(Z)-5-methyl-1-(4-nitrophenyl)-1,5-bis(oxidanyl)hex-1-en-3-one

Systemtic Name: (Z)-5-methyl-1-(4-nitrophenyl)-1,5-bis(oxidanyl)hex-1-en-3-one Openeye Name: (Z)-1,5-dihydroxy-5-methyl-1-(4-nitrophenyl)hex-1-en-3-one CAS Name: (Z)-1,5-dihydroxy-5-methyl-1-(4-nitrophenyl)-1-hexen-3-one IUPAC Name: (Z)-1,5-dihydroxy-5-methyl-1-(4-nitrophenyl)hex-1-en-3-one Traditional Name: (Z)-1,5-dihydroxy-5-methyl-1-(4-nitrophenyl)hex-1-en-3-one Formula: C13H15NO5 MolecularWeight: 265.2619

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO5/c1-13(2,17)8-11(15)7-12(16)9-3-5-10(6-4-9)14(18)19/h3-7,16-17H,8H2,1-2H3/b12-7-