[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl-(2-methylpropyl)-(phenylmethyl)azanium

Systemtic Name: [1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl-(2-methylpropyl)-(phenylmethyl)azanium Openeye Name: benzyl-isobutyl-[[1-(m-tolylmethyl)pyrrol-2-yl]methyl]ammonium CAS Name: [1-[(3-methylphenyl)methyl]-2-pyrrolyl]methyl-(2-methylpropyl)-(phenylmethyl)ammonium IUPAC Name: benzyl-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-(2-methylpropyl)azanium Traditional Name: benzyl-isobutyl-[[1-(3-methylbenzyl)pyrrol-2-yl]methyl]ammonium Formula: C24H31N2+ MolecularWeight: 347.51634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C=CC=C2C[NH+](CC3=CC=CC=C3)CC(C)C

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=CC=C2C[NH+](CC3=CC=CC=C3)CC(C)C

InChI

InChI=1S/C24H30N2/c1-20(2)16-25(17-22-10-5-4-6-11-22)19-24-13-8-14-26(24)18-23-12-7-9-21(3)15-23/h4-15,20H,16-19H2,1-3H3/p+1