5,5-dimethyl-2-[(1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)carbonyl]cyclohexane-1,3-dione

Systemtic Name: 5,5-dimethyl-2-[(1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)carbonyl]cyclohexane-1,3-dione Openeye Name: 5,5-dimethyl-2-(1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-3-carbonyl)cyclohexane-1,3-dione CAS Name: 5,5-dimethyl-2-[oxo-(1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methyl]cyclohexane-1,3-dione IUPAC Name: 5,5-dimethyl-2-(1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-3-carbonyl)cyclohexane-1,3-dione Traditional Name: 5,5-dimethyl-2-(1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-3-carbonyl)cyclohexane-1,3-quinone Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1)C(=O)C2=NN(C3=C2CCC3)C4=CC=CC=C4)C

Isomeric SMILES

CC1(CC(=O)C(C(=O)C1)C(=O)C2=NN(C3=C2CCC3)C4=CC=CC=C4)C

InChI

InChI=1S/C21H22N2O3/c1-21(2)11-16(24)18(17(25)12-21)20(26)19-14-9-6-10-15(14)23(22-19)13-7-4-3-5-8-13/h3-5,7-8,18H,6,9-12H2,1-2H3