2-[(4-chloranyl-2-nitro-phenyl)diazenyl]-5,5-dimethyl-cyclohexane-1,3-dione

Systemtic Name: 2-[(4-chloranyl-2-nitro-phenyl)diazenyl]-5,5-dimethyl-cyclohexane-1,3-dione Openeye Name: 2-(4-chloro-2-nitro-phenyl)azo-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-(4-chloro-2-nitrophenyl)azo-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-[(4-chloro-2-nitrophenyl)diazenyl]-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-(4-chloro-2-nitro-phenyl)azo-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C14H14ClN3O4 MolecularWeight: 323.73166

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1)N=NC2=C(C=C(C=C2)Cl)[N+](=O)[O-])C

Isomeric SMILES

CC1(CC(=O)C(C(=O)C1)N=NC2=C(C=C(C=C2)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C14H14ClN3O4/c1-14(2)6-11(19)13(12(20)7-14)17-16-9-4-3-8(15)5-10(9)18(21)22/h3-5,13H,6-7H2,1-2H3