5,5-dimethyl-2-[[(3-nitrophenyl)amino]methylidene]cyclohexane-1,3-dione

Systemtic Name: 5,5-dimethyl-2-[[(3-nitrophenyl)amino]methylidene]cyclohexane-1,3-dione Openeye Name: 5,5-dimethyl-2-[(3-nitroanilino)methylene]cyclohexane-1,3-dione CAS Name: 5,5-dimethyl-2-[(3-nitroanilino)methylidene]cyclohexane-1,3-dione IUPAC Name: 5,5-dimethyl-2-[(3-nitroanilino)methylidene]cyclohexane-1,3-dione Traditional Name: 5,5-dimethyl-2-[(3-nitroanilino)methylene]cyclohexane-1,3-quinone Formula: C15H16N2O4 MolecularWeight: 288.29854

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(=CNC2=CC(=CC=C2)[N+](=O)[O-])C(=O)C1)C

Isomeric SMILES

CC1(CC(=O)C(=CNC2=CC(=CC=C2)[N+](=O)[O-])C(=O)C1)C

InChI

InChI=1S/C15H16N2O4/c1-15(2)7-13(18)12(14(19)8-15)9-16-10-4-3-5-11(6-10)17(20)21/h3-6,9,16H,7-8H2,1-2H3