2-(2-methylpyrrolidin-1-yl)-4-oxidanylidene-8-(trifluoromethyl)-1H-quinoline-3-carboxylic acid

Systemtic Name: 2-(2-methylpyrrolidin-1-yl)-4-oxidanylidene-8-(trifluoromethyl)-1H-quinoline-3-carboxylic acid Openeye Name: 2-(2-methylpyrrolidin-1-yl)-4-oxo-8-(trifluoromethyl)-1H-quinoline-3-carboxylic acid CAS Name: 2-(2-methyl-1-pyrrolidinyl)-4-oxo-8-(trifluoromethyl)-1H-quinoline-3-carboxylic acid IUPAC Name: 2-(2-methylpyrrolidin-1-yl)-4-oxo-8-(trifluoromethyl)-1H-quinoline-3-carboxylic acid Traditional Name: 4-keto-2-(2-methylpyrrolidino)-8-(trifluoromethyl)-1H-quinoline-3-carboxylic acid Formula: C16H15F3N2O3 MolecularWeight: 340.29711

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN1C2=C(C(=O)C3=C(N2)C(=CC=C3)C(F)(F)F)C(=O)O

Isomeric SMILES

CC1CCCN1C2=C(C(=O)C3=C(N2)C(=CC=C3)C(F)(F)F)C(=O)O

InChI

InChI=1S/C16H15F3N2O3/c1-8-4-3-7-21(8)14-11(15(23)24)13(22)9-5-2-6-10(12(9)20-14)16(17,18)19/h2,5-6,8H,3-4,7H2,1H3,(H,20,22)(H,23,24)