1-cyclopropyl-6-fluoranyl-7-[3-(fluoranylmethyl)-3-(methylamino)piperidin-1-yl]-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-7-[3-(fluoranylmethyl)-3-(methylamino)piperidin-1-yl]-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-[3-(fluoromethyl)-3-(methylamino)-1-piperidyl]-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-[3-(fluoromethyl)-3-(methylamino)-1-piperidinyl]-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-[3-(fluoromethyl)-3-(methylamino)piperidin-1-yl]-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-7-[3-(fluoromethyl)-3-(methylamino)piperidino]-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C21H25F2N3O4 MolecularWeight: 421.437706

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Descriptors Computed from Structure

Canonical SMILES:

CNC1(CCCN(C1)C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)O)C4CC4)F)CF

Isomeric SMILES

CNC1(CCCN(C1)C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)O)C4CC4)F)CF

InChI

InChI=1S/C21H25F2N3O4/c1-24-21(10-22)6-3-7-25(11-21)17-15(23)8-13-16(19(17)30-2)26(12-4-5-12)9-14(18(13)27)20(28)29/h8-9,12,24H,3-7,10-11H2,1-2H3,(H,28,29)