5-methyl-2-[2-(4-nitrophenyl)-2-oxidanylidene-ethyl]cyclohexane-1,3-dione

Systemtic Name: 5-methyl-2-[2-(4-nitrophenyl)-2-oxidanylidene-ethyl]cyclohexane-1,3-dione Openeye Name: 5-methyl-2-[2-(4-nitrophenyl)-2-oxo-ethyl]cyclohexane-1,3-dione CAS Name: 5-methyl-2-[2-(4-nitrophenyl)-2-oxoethyl]cyclohexane-1,3-dione IUPAC Name: 5-methyl-2-[2-(4-nitrophenyl)-2-oxoethyl]cyclohexane-1,3-dione Traditional Name: 2-[2-keto-2-(4-nitrophenyl)ethyl]-5-methyl-cyclohexane-1,3-quinone Formula: C15H15NO5 MolecularWeight: 289.2833

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C(C(=O)C1)CC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1CC(=O)C(C(=O)C1)CC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H15NO5/c1-9-6-14(18)12(15(19)7-9)8-13(17)10-2-4-11(5-3-10)16(20)21/h2-5,9,12H,6-8H2,1H3