1-[[1-(3-methylphenyl)pyrrol-2-yl]methyl]piperidin-1-ium

Systemtic Name: 1-[[1-(3-methylphenyl)pyrrol-2-yl]methyl]piperidin-1-ium Openeye Name: 1-[[1-(m-tolyl)pyrrol-2-yl]methyl]piperidin-1-ium CAS Name: 1-[[1-(3-methylphenyl)-2-pyrrolyl]methyl]piperidin-1-ium IUPAC Name: 1-[[1-(3-methylphenyl)pyrrol-2-yl]methyl]piperidin-1-ium Traditional Name: 1-[[1-(m-tolyl)pyrrol-2-yl]methyl]piperidin-1-ium Formula: C17H23N2+ MolecularWeight: 255.37792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C=CC=C2C[NH+]3CCCCC3

Isomeric SMILES

CC1=CC(=CC=C1)N2C=CC=C2C[NH+]3CCCCC3

InChI

InChI=1S/C17H22N2/c1-15-7-5-8-16(13-15)19-12-6-9-17(19)14-18-10-3-2-4-11-18/h5-9,12-13H,2-4,10-11,14H2,1H3/p+1