7-[3-(aminomethyl)-3-pyridin-2-yl-pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[3-(aminomethyl)-3-pyridin-2-yl-pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[3-(aminomethyl)-3-(2-pyridyl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[3-(aminomethyl)-3-(2-pyridinyl)-1-pyrrolidinyl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[3-(aminomethyl)-3-pyridin-2-ylpyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[3-(aminomethyl)-3-(2-pyridyl)pyrrolidino]-1-cyclopropyl-6-fluoro-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C24H25FN4O4 MolecularWeight: 452.478103

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1N3CCC(C3)(CN)C4=CC=CC=N4)F)C(=O)C(=CN2C5CC5)C(=O)O

Isomeric SMILES

COC1=C2C(=CC(=C1N3CCC(C3)(CN)C4=CC=CC=N4)F)C(=O)C(=CN2C5CC5)C(=O)O

InChI

InChI=1S/C24H25FN4O4/c1-33-22-19-15(21(30)16(23(31)32)11-29(19)14-5-6-14)10-17(25)20(22)28-9-7-24(12-26,13-28)18-4-2-3-8-27-18/h2-4,8,10-11,14H,5-7,9,12-13,26H2,1H3,(H,31,32)