4-[6-methyl-3-oxidanylidene-8-(trifluoromethyl)-1H-pyrazolo[4,3-c]quinolin-2-yl]benzoic acid

Systemtic Name: 4-[6-methyl-3-oxidanylidene-8-(trifluoromethyl)-1H-pyrazolo[4,3-c]quinolin-2-yl]benzoic acid Openeye Name: 4-[6-methyl-3-oxo-8-(trifluoromethyl)-1H-pyrazolo[4,3-c]quinolin-2-yl]benzoic acid CAS Name: 4-[6-methyl-3-oxo-8-(trifluoromethyl)-1H-pyrazolo[4,3-c]quinolin-2-yl]benzoic acid IUPAC Name: 4-[6-methyl-3-oxo-8-(trifluoromethyl)-1H-pyrazolo[4,3-c]quinolin-2-yl]benzoic acid Traditional Name: 4-[3-keto-6-methyl-8-(trifluoromethyl)-1H-pyrazolo[4,3-c]quinolin-2-yl]benzoic acid Formula: C19H12F3N3O3 MolecularWeight: 387.31209

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)C(F)(F)F)C3=C(C=N2)C(=O)N(N3)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CC1=C2C(=CC(=C1)C(F)(F)F)C3=C(C=N2)C(=O)N(N3)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C19H12F3N3O3/c1-9-6-11(19(20,21)22)7-13-15(9)23-8-14-16(13)24-25(17(14)26)12-4-2-10(3-5-12)18(27)28/h2-8,24H,1H3,(H,27,28)