7-[3-(aminomethyl)pyrrolidin-1-yl]-1-tert-butyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[3-(aminomethyl)pyrrolidin-1-yl]-1-tert-butyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[3-(aminomethyl)pyrrolidin-1-yl]-1-tert-butyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[3-(aminomethyl)-1-pyrrolidinyl]-1-tert-butyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[3-(aminomethyl)pyrrolidin-1-yl]-1-tert-butyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[3-(aminomethyl)pyrrolidino]-1-tert-butyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C19H24FN3O3 MolecularWeight: 361.410563

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=C(C(=O)C2=CC(=C(C=C21)N3CCC(C3)CN)F)C(=O)O

Isomeric SMILES

CC(C)(C)N1C=C(C(=O)C2=CC(=C(C=C21)N3CCC(C3)CN)F)C(=O)O

InChI

InChI=1S/C19H24FN3O3/c1-19(2,3)23-10-13(18(25)26)17(24)12-6-14(20)16(7-15(12)23)22-5-4-11(8-21)9-22/h6-7,10-11H,4-5,8-9,21H2,1-3H3,(H,25,26)