1-cyclopropyl-6,8-bis(fluoranyl)-7-[2-(hydroxymethyl)-6-methyl-pyridin-4-yl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6,8-bis(fluoranyl)-7-[2-(hydroxymethyl)-6-methyl-pyridin-4-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6,8-difluoro-7-[2-(hydroxymethyl)-6-methyl-4-pyridyl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6,8-difluoro-7-[2-(hydroxymethyl)-6-methyl-4-pyridinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6,8-difluoro-7-[2-(hydroxymethyl)-6-methylpyridin-4-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6,8-difluoro-4-keto-7-(2-methyl-6-methylol-4-pyridyl)quinoline-3-carboxylic acid Formula: C20H16F2N2O4 MolecularWeight: 386.348846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=C1)C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)C4CC4)F)CO

Isomeric SMILES

CC1=NC(=CC(=C1)C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)C4CC4)F)CO

InChI

InChI=1S/C20H16F2N2O4/c1-9-4-10(5-11(8-25)23-9)16-15(21)6-13-18(17(16)22)24(12-2-3-12)7-14(19(13)26)20(27)28/h4-7,12,25H,2-3,8H2,1H3,(H,27,28)