2-(2-methyl-4,6-dinitro-phenyl)cyclohexane-1,3-dione

Systemtic Name: 2-(2-methyl-4,6-dinitro-phenyl)cyclohexane-1,3-dione Openeye Name: 2-(2-methyl-4,6-dinitro-phenyl)cyclohexane-1,3-dione CAS Name: 2-(2-methyl-4,6-dinitrophenyl)cyclohexane-1,3-dione IUPAC Name: 2-(2-methyl-4,6-dinitrophenyl)cyclohexane-1,3-dione Traditional Name: 2-(2-methyl-4,6-dinitro-phenyl)cyclohexane-1,3-quinone Formula: C13H12N2O6 MolecularWeight: 292.24418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C2C(=O)CCCC2=O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1C2C(=O)CCCC2=O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H12N2O6/c1-7-5-8(14(18)19)6-9(15(20)21)12(7)13-10(16)3-2-4-11(13)17/h5-6,13H,2-4H2,1H3