2-(2-chloranyl-6-nitro-phenyl)-5,5-dimethyl-cyclohexane-1,3-dione

Systemtic Name: 2-(2-chloranyl-6-nitro-phenyl)-5,5-dimethyl-cyclohexane-1,3-dione Openeye Name: 2-(2-chloro-6-nitro-phenyl)-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-(2-chloro-6-nitrophenyl)-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-(2-chloro-6-nitrophenyl)-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-(2-chloro-6-nitro-phenyl)-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C14H14ClNO4 MolecularWeight: 295.71826

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1)C2=C(C=CC=C2Cl)[N+](=O)[O-])C

Isomeric SMILES

CC1(CC(=O)C(C(=O)C1)C2=C(C=CC=C2Cl)[N+](=O)[O-])C

InChI

InChI=1S/C14H14ClNO4/c1-14(2)6-10(17)13(11(18)7-14)12-8(15)4-3-5-9(12)16(19)20/h3-5,13H,6-7H2,1-2H3