2-(4-chloranyl-2-nitro-phenyl)carbonyl-4,4-dimethyl-cyclohexane-1,3-dione

Systemtic Name: 2-(4-chloranyl-2-nitro-phenyl)carbonyl-4,4-dimethyl-cyclohexane-1,3-dione Openeye Name: 2-(4-chloro-2-nitro-benzoyl)-4,4-dimethyl-cyclohexane-1,3-dione CAS Name: 2-[(4-chloro-2-nitrophenyl)-oxomethyl]-4,4-dimethylcyclohexane-1,3-dione IUPAC Name: 2-(4-chloro-2-nitrobenzoyl)-4,4-dimethylcyclohexane-1,3-dione Traditional Name: 2-(4-chloro-2-nitro-benzoyl)-4,4-dimethyl-cyclohexane-1,3-quinone Formula: C15H14ClNO5 MolecularWeight: 323.72836

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(=O)C(C1=O)C(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-])C

Isomeric SMILES

CC1(CCC(=O)C(C1=O)C(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C15H14ClNO5/c1-15(2)6-5-11(18)12(14(15)20)13(19)9-4-3-8(16)7-10(9)17(21)22/h3-4,7,12H,5-6H2,1-2H3