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

Systemtic Name: 2-[3-(aminomethyl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 2-[3-(aminomethyl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 2-[3-(aminomethyl)-1-pyrrolidinyl]-1-cyclopropyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 2-[3-(aminomethyl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 2-[3-(aminomethyl)pyrrolidino]-1-cyclopropyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C18H20FN3O3 MolecularWeight: 345.368103

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C3=C(C=C(C=C3)F)C(=O)C(=C2N4CCC(C4)CN)C(=O)O

Isomeric SMILES

C1CC1N2C3=C(C=C(C=C3)F)C(=O)C(=C2N4CCC(C4)CN)C(=O)O

InChI

InChI=1S/C18H20FN3O3/c19-11-1-4-14-13(7-11)16(23)15(18(24)25)17(22(14)12-2-3-12)21-6-5-10(8-20)9-21/h1,4,7,10,12H,2-3,5-6,8-9,20H2,(H,24,25)