N-(3-fluorophenyl)-2-(4-quinolin-1-ium-2-ylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(3-fluorophenyl)-2-(4-quinolin-1-ium-2-ylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(3-fluorophenyl)-2-(4-quinolin-1-ium-2-ylpiperazin-1-ium-1-yl)acetamide CAS Name: N-(3-fluorophenyl)-2-[4-(2-quinolin-1-iumyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(3-fluorophenyl)-2-(4-quinolin-1-ium-2-ylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(3-fluorophenyl)-2-(4-quinolin-1-ium-2-ylpiperazin-1-ium-1-yl)acetamide Formula: C21H23FN4O+2 MolecularWeight: 366.431923

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC(=CC=C2)F)C3=[NH+]C4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC(=CC=C2)F)C3=[NH+]C4=CC=CC=C4C=C3

InChI

InChI=1S/C21H21FN4O/c22-17-5-3-6-18(14-17)23-21(27)15-25-10-12-26(13-11-25)20-9-8-16-4-1-2-7-19(16)24-20/h1-9,14H,10-13,15H2,(H,23,27)/p+2