7-[3-(aminomethyl)piperidin-1-yl]-8-azanyl-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[3-(aminomethyl)piperidin-1-yl]-8-azanyl-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 8-amino-7-[3-(aminomethyl)-1-piperidyl]-1-cyclopropyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 8-amino-7-[3-(aminomethyl)-1-piperidinyl]-1-cyclopropyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 8-amino-7-[3-(aminomethyl)piperidin-1-yl]-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 8-amino-7-[3-(aminomethyl)piperidino]-1-cyclopropyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C19H23FN4O3 MolecularWeight: 374.409323

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=C(C=C3C(=C2N)N(C=C(C3=O)C(=O)O)C4CC4)F)CN

Isomeric SMILES

C1CC(CN(C1)C2=C(C=C3C(=C2N)N(C=C(C3=O)C(=O)O)C4CC4)F)CN

InChI

InChI=1S/C19H23FN4O3/c20-14-6-12-16(15(22)17(14)23-5-1-2-10(7-21)8-23)24(11-3-4-11)9-13(18(12)25)19(26)27/h6,9-11H,1-5,7-8,21-22H2,(H,26,27)