1-(2-fluorophenyl)-4-[[1-(6-methoxypyridin-3-yl)pyrrol-2-yl]methyl]piperazin-4-ium

Systemtic Name: 1-(2-fluorophenyl)-4-[[1-(6-methoxypyridin-3-yl)pyrrol-2-yl]methyl]piperazin-4-ium Openeye Name: 1-(2-fluorophenyl)-4-[[1-(6-methoxy-3-pyridyl)pyrrol-2-yl]methyl]piperazin-4-ium CAS Name: 1-(2-fluorophenyl)-4-[[1-(6-methoxy-3-pyridinyl)-2-pyrrolyl]methyl]piperazin-4-ium IUPAC Name: 1-(2-fluorophenyl)-4-[[1-(6-methoxypyridin-3-yl)pyrrol-2-yl]methyl]piperazin-4-ium Traditional Name: 1-(2-fluorophenyl)-4-[[1-(6-methoxy-3-pyridyl)pyrrol-2-yl]methyl]piperazin-4-ium Formula: C21H24FN4O+ MolecularWeight: 367.439863

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)N2C=CC=C2C[NH+]3CCN(CC3)C4=CC=CC=C4F

Isomeric SMILES

COC1=NC=C(C=C1)N2C=CC=C2C[NH+]3CCN(CC3)C4=CC=CC=C4F

InChI

InChI=1S/C21H23FN4O/c1-27-21-9-8-17(15-23-21)26-10-4-5-18(26)16-24-11-13-25(14-12-24)20-7-3-2-6-19(20)22/h2-10,15H,11-14,16H2,1H3/p+1