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

Systemtic Name: 1-[[1-(3-methylphenyl)pyrrol-2-yl]methyl]-4-phenyl-piperazin-1-ium Openeye Name: 1-[[1-(m-tolyl)pyrrol-2-yl]methyl]-4-phenyl-piperazin-1-ium CAS Name: 1-[[1-(3-methylphenyl)-2-pyrrolyl]methyl]-4-phenylpiperazin-1-ium IUPAC Name: 1-[[1-(3-methylphenyl)pyrrol-2-yl]methyl]-4-phenylpiperazin-1-ium Traditional Name: 1-[[1-(m-tolyl)pyrrol-2-yl]methyl]-4-phenyl-piperazin-1-ium Formula: C22H26N3+ MolecularWeight: 332.46194

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3/c1-19-7-5-10-21(17-19)25-12-6-11-22(25)18-23-13-15-24(16-14-23)20-8-3-2-4-9-20/h2-12,17H,13-16,18H2,1H3/p+1