(2Z)-4,4-dimethyl-2-[(3-nitrophenyl)methylidene]cyclohexane-1,3-dione

Systemtic Name: (2Z)-4,4-dimethyl-2-[(3-nitrophenyl)methylidene]cyclohexane-1,3-dione Openeye Name: (2Z)-4,4-dimethyl-2-[(3-nitrophenyl)methylene]cyclohexane-1,3-dione CAS Name: (2Z)-4,4-dimethyl-2-[(3-nitrophenyl)methylidene]cyclohexane-1,3-dione IUPAC Name: (2Z)-4,4-dimethyl-2-[(3-nitrophenyl)methylidene]cyclohexane-1,3-dione Traditional Name: (2Z)-4,4-dimethyl-2-(3-nitrobenzylidene)cyclohexane-1,3-quinone Formula: C15H15NO4 MolecularWeight: 273.2839

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(=O)C(=CC2=CC(=CC=C2)[N+](=O)[O-])C1=O)C

Isomeric SMILES

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

InChI

InChI=1S/C15H15NO4/c1-15(2)7-6-13(17)12(14(15)18)9-10-4-3-5-11(8-10)16(19)20/h3-5,8-9H,6-7H2,1-2H3/b12-9-