2-(3,3-dimethyl-7-nitro-1-oxidanylidene-4,9-dihydro-2H-xanthen-9-yl)-5,5-dimethyl-cyclohexane-1,3-dione

Systemtic Name: 2-(3,3-dimethyl-7-nitro-1-oxidanylidene-4,9-dihydro-2H-xanthen-9-yl)-5,5-dimethyl-cyclohexane-1,3-dione Openeye Name: 2-(3,3-dimethyl-7-nitro-1-oxo-4,9-dihydro-2H-xanthen-9-yl)-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-(3,3-dimethyl-7-nitro-1-oxo-4,9-dihydro-2H-xanthen-9-yl)-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-(3,3-dimethyl-7-nitro-1-oxo-4,9-dihydro-2H-xanthen-9-yl)-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-(1-keto-3,3-dimethyl-7-nitro-4,9-dihydro-2H-xanthen-9-yl)-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C23H25NO6 MolecularWeight: 411.4477

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1)C2C3=C(C=CC(=C3)[N+](=O)[O-])OC4=C2C(=O)CC(C4)(C)C)C

Isomeric SMILES

CC1(CC(=O)C(C(=O)C1)C2C3=C(C=CC(=C3)[N+](=O)[O-])OC4=C2C(=O)CC(C4)(C)C)C

InChI

InChI=1S/C23H25NO6/c1-22(2)8-14(25)20(15(26)9-22)19-13-7-12(24(28)29)5-6-17(13)30-18-11-23(3,4)10-16(27)21(18)19/h5-7,19-20H,8-11H2,1-4H3