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

Systemtic Name: 3-[(3,4-dimethyl-5-nitro-phenyl)amino]-5,5-dimethyl-cyclohex-2-en-1-one Openeye Name: 3-(3,4-dimethyl-5-nitro-anilino)-5,5-dimethyl-cyclohex-2-en-1-one CAS Name: 3-(3,4-dimethyl-5-nitroanilino)-5,5-dimethyl-1-cyclohex-2-enone IUPAC Name: 3-(3,4-dimethyl-5-nitroanilino)-5,5-dimethylcyclohex-2-en-1-one Traditional Name: 3-(3,4-dimethyl-5-nitro-anilino)-5,5-dimethyl-cyclohex-2-en-1-one Formula: C16H20N2O3 MolecularWeight: 288.3416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)[N+](=O)[O-])NC2=CC(=O)CC(C2)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1C)[N+](=O)[O-])NC2=CC(=O)CC(C2)(C)C

InChI

InChI=1S/C16H20N2O3/c1-10-5-12(7-15(11(10)2)18(20)21)17-13-6-14(19)9-16(3,4)8-13/h5-7,17H,8-9H2,1-4H3