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

Systemtic Name: 7-[3-(aminomethyl)pyrrolidin-1-yl]-1-(4-ethanoylphenyl)-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-(4-acetylphenyl)-7-[3-(aminomethyl)pyrrolidin-1-yl]-6-fluoro-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-(4-acetylphenyl)-7-[3-(aminomethyl)-1-pyrrolidinyl]-6-fluoro-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-(4-acetylphenyl)-7-[3-(aminomethyl)pyrrolidin-1-yl]-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-(4-acetylphenyl)-7-[3-(aminomethyl)pyrrolidino]-6-fluoro-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C24H24FN3O5 MolecularWeight: 453.462863

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2C=C(C(=O)C3=CC(=C(C(=C32)OC)N4CCC(C4)CN)F)C(=O)O

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2C=C(C(=O)C3=CC(=C(C(=C32)OC)N4CCC(C4)CN)F)C(=O)O

InChI

InChI=1S/C24H24FN3O5/c1-13(29)15-3-5-16(6-4-15)28-12-18(24(31)32)22(30)17-9-19(25)21(23(33-2)20(17)28)27-8-7-14(10-26)11-27/h3-6,9,12,14H,7-8,10-11,26H2,1-2H3,(H,31,32)