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

Systemtic Name: 1-(2-fluorophenyl)-4-[[1-(3-methylphenyl)pyrrol-2-yl]methyl]piperazin-4-ium Openeye Name: 1-(2-fluorophenyl)-4-[[1-(m-tolyl)pyrrol-2-yl]methyl]piperazin-4-ium CAS Name: 1-(2-fluorophenyl)-4-[[1-(3-methylphenyl)-2-pyrrolyl]methyl]piperazin-4-ium IUPAC Name: 1-(2-fluorophenyl)-4-[[1-(3-methylphenyl)pyrrol-2-yl]methyl]piperazin-4-ium Traditional Name: 1-(2-fluorophenyl)-4-[[1-(m-tolyl)pyrrol-2-yl]methyl]piperazin-4-ium Formula: C22H25FN3+ MolecularWeight: 350.452403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C=CC=C2C[NH+]3CCN(CC3)C4=CC=CC=C4F

Isomeric SMILES

CC1=CC(=CC=C1)N2C=CC=C2C[NH+]3CCN(CC3)C4=CC=CC=C4F

InChI

InChI=1S/C22H24FN3/c1-18-6-4-7-19(16-18)26-11-5-8-20(26)17-24-12-14-25(15-13-24)22-10-3-2-9-21(22)23/h2-11,16H,12-15,17H2,1H3/p+1