7-fluoranyl-2-methyl-N-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-1-ium-4-yl]quinoline-3-carboxamide

Systemtic Name: 7-fluoranyl-2-methyl-N-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-1-ium-4-yl]quinoline-3-carboxamide Openeye Name: N-[1-(2-anilino-2-oxo-ethyl)piperidin-1-ium-4-yl]-7-fluoro-2-methyl-quinoline-3-carboxamide CAS Name: N-[1-(2-anilino-2-oxoethyl)-4-piperidin-1-iumyl]-7-fluoro-2-methyl-3-quinolinecarboxamide IUPAC Name: N-[1-(2-anilino-2-oxoethyl)piperidin-1-ium-4-yl]-7-fluoro-2-methylquinoline-3-carboxamide Traditional Name: N-[1-(2-anilino-2-keto-ethyl)piperidin-1-ium-4-yl]-7-fluoro-2-methyl-quinoline-3-carboxamide Formula: C24H26FN4O2+ MolecularWeight: 421.487243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=CC(=CC2=N1)F)C(=O)NC3CC[NH+](CC3)CC(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C2C=CC(=CC2=N1)F)C(=O)NC3CC[NH+](CC3)CC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C24H25FN4O2/c1-16-21(13-17-7-8-18(25)14-22(17)26-16)24(31)28-20-9-11-29(12-10-20)15-23(30)27-19-5-3-2-4-6-19/h2-8,13-14,20H,9-12,15H2,1H3,(H,27,30)(H,28,31)/p+1