1-cyclopropyl-7-[3-[(cyclopropylamino)methyl]-4-fluoranyl-pyrrolidin-1-yl]-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-7-[3-[(cyclopropylamino)methyl]-4-fluoranyl-pyrrolidin-1-yl]-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-[3-[(cyclopropylamino)methyl]-4-fluoro-pyrrolidin-1-yl]-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-[3-[(cyclopropylamino)methyl]-4-fluoro-1-pyrrolidinyl]-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-[3-[(cyclopropylamino)methyl]-4-fluoropyrrolidin-1-yl]-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-7-[3-[(cyclopropylamino)methyl]-4-fluoro-pyrrolidino]-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C22H26FN3O4 MolecularWeight: 415.457943

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC2=C1N(C=C(C2=O)C(=O)O)C3CC3)N4CC(C(C4)F)CNC5CC5

Isomeric SMILES

COC1=C(C=CC2=C1N(C=C(C2=O)C(=O)O)C3CC3)N4CC(C(C4)F)CNC5CC5

InChI

InChI=1S/C22H26FN3O4/c1-30-21-18(25-9-12(17(23)11-25)8-24-13-2-3-13)7-6-15-19(21)26(14-4-5-14)10-16(20(15)27)22(28)29/h6-7,10,12-14,17,24H,2-5,8-9,11H2,1H3,(H,28,29)