5,5-dimethyl-2-(3-nitro-2-oxidanyl-1-phenyl-quinolin-4-ylidene)cyclohexane-1,3-dione

Systemtic Name: 5,5-dimethyl-2-(3-nitro-2-oxidanyl-1-phenyl-quinolin-4-ylidene)cyclohexane-1,3-dione Openeye Name: 2-(2-hydroxy-3-nitro-1-phenyl-4-quinolylidene)-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-(2-hydroxy-3-nitro-1-phenyl-4-quinolinylidene)-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-(2-hydroxy-3-nitro-1-phenylquinolin-4-ylidene)-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-(2-hydroxy-3-nitro-1-phenyl-4-quinolylidene)-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C23H20N2O5 MolecularWeight: 404.4153

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(=C2C3=CC=CC=C3N(C(=C2[N+](=O)[O-])O)C4=CC=CC=C4)C(=O)C1)C

Isomeric SMILES

CC1(CC(=O)C(=C2C3=CC=CC=C3N(C(=C2[N+](=O)[O-])O)C4=CC=CC=C4)C(=O)C1)C

InChI

InChI=1S/C23H20N2O5/c1-23(2)12-17(26)20(18(27)13-23)19-15-10-6-7-11-16(15)24(14-8-4-3-5-9-14)22(28)21(19)25(29)30/h3-11,28H,12-13H2,1-2H3