3-[(4-chloranyl-3-nitro-phenyl)amino]-5,5-dimethyl-cyclohex-2-en-1-one

Systemtic Name: 3-[(4-chloranyl-3-nitro-phenyl)amino]-5,5-dimethyl-cyclohex-2-en-1-one Openeye Name: 3-(4-chloro-3-nitro-anilino)-5,5-dimethyl-cyclohex-2-en-1-one CAS Name: 3-(4-chloro-3-nitroanilino)-5,5-dimethyl-1-cyclohex-2-enone IUPAC Name: 3-(4-chloro-3-nitroanilino)-5,5-dimethylcyclohex-2-en-1-one Traditional Name: 3-(4-chloro-3-nitro-anilino)-5,5-dimethyl-cyclohex-2-en-1-one Formula: C14H15ClN2O3 MolecularWeight: 294.7335

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15ClN2O3/c1-14(2)7-10(5-11(18)8-14)16-9-3-4-12(15)13(6-9)17(19)20/h3-6,16H,7-8H2,1-2H3