[2,5-dimethyl-1-(2-methylpropyl)pyrrol-3-yl]methyl-[(4-methylphenyl)methyl]azanium

Systemtic Name: [2,5-dimethyl-1-(2-methylpropyl)pyrrol-3-yl]methyl-[(4-methylphenyl)methyl]azanium Openeye Name: (1-isobutyl-2,5-dimethyl-pyrrol-3-yl)methyl-(p-tolylmethyl)ammonium CAS Name: [2,5-dimethyl-1-(2-methylpropyl)-3-pyrrolyl]methyl-[(4-methylphenyl)methyl]ammonium IUPAC Name: [2,5-dimethyl-1-(2-methylpropyl)pyrrol-3-yl]methyl-[(4-methylphenyl)methyl]azanium Traditional Name: (1-isobutyl-2,5-dimethyl-pyrrol-3-yl)methyl-(4-methylbenzyl)ammonium Formula: C19H29N2+ MolecularWeight: 285.44696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH2+]CC2=C(N(C(=C2)C)CC(C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C[NH2+]CC2=C(N(C(=C2)C)CC(C)C)C

InChI

InChI=1S/C19H28N2/c1-14(2)13-21-16(4)10-19(17(21)5)12-20-11-18-8-6-15(3)7-9-18/h6-10,14,20H,11-13H2,1-5H3/p+1