2-[4-(2-fluorophenyl)piperazin-1-yl]-N-(2-hydroxyethyl)-6-(2-methoxyphenyl)-N-methyl-pyridin-1-ium-3-carboxamide

Systemtic Name: 2-[4-(2-fluorophenyl)piperazin-1-yl]-N-(2-hydroxyethyl)-6-(2-methoxyphenyl)-N-methyl-pyridin-1-ium-3-carboxamide Openeye Name: 2-[4-(2-fluorophenyl)piperazin-1-yl]-N-(2-hydroxyethyl)-6-(2-methoxyphenyl)-N-methyl-pyridin-1-ium-3-carboxamide CAS Name: 2-[4-(2-fluorophenyl)-1-piperazinyl]-N-(2-hydroxyethyl)-6-(2-methoxyphenyl)-N-methyl-3-pyridin-1-iumcarboxamide IUPAC Name: 2-[4-(2-fluorophenyl)piperazin-1-yl]-N-(2-hydroxyethyl)-6-(2-methoxyphenyl)-N-methylpyridin-1-ium-3-carboxamide Traditional Name: 2-[4-(2-fluorophenyl)piperazino]-N-(2-hydroxyethyl)-6-(2-methoxyphenyl)-N-methyl-pyridin-1-ium-3-carboxamide Formula: C26H30FN4O3+ MolecularWeight: 465.539803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCO)C(=O)C1=C([NH+]=C(C=C1)C2=CC=CC=C2OC)N3CCN(CC3)C4=CC=CC=C4F

Isomeric SMILES

CN(CCO)C(=O)C1=C([NH+]=C(C=C1)C2=CC=CC=C2OC)N3CCN(CC3)C4=CC=CC=C4F

InChI

InChI=1S/C26H29FN4O3/c1-29(17-18-32)26(33)20-11-12-22(19-7-3-6-10-24(19)34-2)28-25(20)31-15-13-30(14-16-31)23-9-5-4-8-21(23)27/h3-12,32H,13-18H2,1-2H3/p+1