3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-4H-pyrazol-1-ium-4-yl)iminomethyl]-6-methyl-4a,10b-dihydropyrano[3,2-c]quinoline-4,5-dione

Systemtic Name: 3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-4H-pyrazol-1-ium-4-yl)iminomethyl]-6-methyl-4a,10b-dihydropyrano[3,2-c]quinoline-4,5-dione Openeye Name: 3-[(1,5-dimethyl-3-oxo-2-phenyl-4H-pyrazol-1-ium-4-yl)iminomethyl]-6-methyl-4a,10b-dihydropyrano[3,2-c]quinoline-4,5-dione CAS Name: 3-[(1,5-dimethyl-3-oxo-2-phenyl-4H-pyrazol-1-ium-4-yl)iminomethyl]-6-methyl-4a,10b-dihydropyrano[3,2-c]quinoline-4,5-dione IUPAC Name: 3-[(1,5-dimethyl-3-oxo-2-phenyl-4H-pyrazol-1-ium-4-yl)iminomethyl]-6-methyl-4a,10b-dihydropyrano[3,2-c]quinoline-4,5-dione Traditional Name: 3-[(3-keto-1,5-dimethyl-2-phenyl-2-pyrazolin-1-ium-4-yl)iminomethyl]-6-methyl-4a,10b-dihydropyrano[3,2-c]quinoline-4,5-quinone Formula: C25H23N4O4+ MolecularWeight: 443.47452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](N(C(=O)C1N=CC2=COC3C(C2=O)C(=O)N(C4=CC=CC=C34)C)C5=CC=CC=C5)C

Isomeric SMILES

CC1=[N+](N(C(=O)C1N=CC2=COC3C(C2=O)C(=O)N(C4=CC=CC=C34)C)C5=CC=CC=C5)C

InChI

InChI=1S/C25H23N4O4/c1-15-21(25(32)29(28(15)3)17-9-5-4-6-10-17)26-13-16-14-33-23-18-11-7-8-12-19(18)27(2)24(31)20(23)22(16)30/h4-14,20-21,23H,1-3H3/q+1