7-[3-(aminomethyl)pyrrolidin-1-yl]-6-fluoranyl-1-(4-methoxyphenyl)-4-oxidanylidene-1,8-naphthyridine-3-carboxylic acid

Systemtic Name: 7-[3-(aminomethyl)pyrrolidin-1-yl]-6-fluoranyl-1-(4-methoxyphenyl)-4-oxidanylidene-1,8-naphthyridine-3-carboxylic acid Openeye Name: 7-[3-(aminomethyl)pyrrolidin-1-yl]-6-fluoro-1-(4-methoxyphenyl)-4-oxo-1,8-naphthyridine-3-carboxylic acid CAS Name: 7-[3-(aminomethyl)-1-pyrrolidinyl]-6-fluoro-1-(4-methoxyphenyl)-4-oxo-1,8-naphthyridine-3-carboxylic acid IUPAC Name: 7-[3-(aminomethyl)pyrrolidin-1-yl]-6-fluoro-1-(4-methoxyphenyl)-4-oxo-1,8-naphthyridine-3-carboxylic acid Traditional Name: 7-[3-(aminomethyl)pyrrolidino]-6-fluoro-4-keto-1-(4-methoxyphenyl)-1,8-naphthyridine-3-carboxylic acid Formula: C21H21FN4O4 MolecularWeight: 412.414243

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C=C(C(=O)C3=CC(=C(N=C32)N4CCC(C4)CN)F)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)N2C=C(C(=O)C3=CC(=C(N=C32)N4CCC(C4)CN)F)C(=O)O

InChI

InChI=1S/C21H21FN4O4/c1-30-14-4-2-13(3-5-14)26-11-16(21(28)29)18(27)15-8-17(22)20(24-19(15)26)25-7-6-12(9-23)10-25/h2-5,8,11-12H,6-7,9-10,23H2,1H3,(H,28,29)