4-[2-(4-fluorophenyl)-5-(1-methylpiperidin-1-ium-1-yl)-1H-pyrrol-3-yl]pyridine

Systemtic Name: 4-[2-(4-fluorophenyl)-5-(1-methylpiperidin-1-ium-1-yl)-1H-pyrrol-3-yl]pyridine Openeye Name: 4-[2-(4-fluorophenyl)-5-(1-methylpiperidin-1-ium-1-yl)-1H-pyrrol-3-yl]pyridine CAS Name: 4-[2-(4-fluorophenyl)-5-(1-methyl-1-piperidin-1-iumyl)-1H-pyrrol-3-yl]pyridine IUPAC Name: 4-[2-(4-fluorophenyl)-5-(1-methylpiperidin-1-ium-1-yl)-1H-pyrrol-3-yl]pyridine Traditional Name: 4-[2-(4-fluorophenyl)-5-(1-methylpiperidin-1-ium-1-yl)-1H-pyrrol-3-yl]pyridine Formula: C21H23FN3+ MolecularWeight: 336.425823

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1)C2=CC(=C(N2)C3=CC=C(C=C3)F)C4=CC=NC=C4

Isomeric SMILES

C[N+]1(CCCCC1)C2=CC(=C(N2)C3=CC=C(C=C3)F)C4=CC=NC=C4

InChI

InChI=1S/C21H23FN3/c1-25(13-3-2-4-14-25)20-15-19(16-9-11-23-12-10-16)21(24-20)17-5-7-18(22)8-6-17/h5-12,15,24H,2-4,13-14H2,1H3/q+1