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

Systemtic Name: 1-(2,3-dimethylphenyl)-4-[[1-(3-methylphenyl)pyrrol-2-yl]methyl]piperazin-4-ium Openeye Name: 1-(2,3-dimethylphenyl)-4-[[1-(m-tolyl)pyrrol-2-yl]methyl]piperazin-4-ium CAS Name: 1-(2,3-dimethylphenyl)-4-[[1-(3-methylphenyl)-2-pyrrolyl]methyl]piperazin-4-ium IUPAC Name: 1-(2,3-dimethylphenyl)-4-[[1-(3-methylphenyl)pyrrol-2-yl]methyl]piperazin-4-ium Traditional Name: 1-(2,3-dimethylphenyl)-4-[[1-(m-tolyl)pyrrol-2-yl]methyl]piperazin-4-ium Formula: C24H30N3+ MolecularWeight: 360.5151

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C=CC=C2C[NH+]3CCN(CC3)C4=CC=CC(=C4C)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C=CC=C2C[NH+]3CCN(CC3)C4=CC=CC(=C4C)C

InChI

InChI=1S/C24H29N3/c1-19-7-4-9-22(17-19)27-12-6-10-23(27)18-25-13-15-26(16-14-25)24-11-5-8-20(2)21(24)3/h4-12,17H,13-16,18H2,1-3H3/p+1