1-cyclopropyl-6-fluoranyl-7-[3-[3-(methylaminomethyl)phenyl]pyrrolidin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-7-[3-[3-(methylaminomethyl)phenyl]pyrrolidin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-[3-[3-(methylaminomethyl)phenyl]pyrrolidin-1-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-[3-[3-(methylaminomethyl)phenyl]-1-pyrrolidinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-[3-[3-(methylaminomethyl)phenyl]pyrrolidin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-[3-[3-(methylaminomethyl)phenyl]pyrrolidino]quinoline-3-carboxylic acid Formula: C25H26FN3O3 MolecularWeight: 435.490643

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1=CC=CC(=C1)C2CCN(C2)C3=C(C=C4C(=C3)N(C=C(C4=O)C(=O)O)C5CC5)F

Isomeric SMILES

CNCC1=CC=CC(=C1)C2CCN(C2)C3=C(C=C4C(=C3)N(C=C(C4=O)C(=O)O)C5CC5)F

InChI

InChI=1S/C25H26FN3O3/c1-27-12-15-3-2-4-16(9-15)17-7-8-28(13-17)23-11-22-19(10-21(23)26)24(30)20(25(31)32)14-29(22)18-5-6-18/h2-4,9-11,14,17-18,27H,5-8,12-13H2,1H3,(H,31,32)