[2-(dimethylamino)quinolin-3-yl]methyl-[(4-methylphenyl)methyl]-(pyridin-4-ylmethyl)azanium

Systemtic Name: [2-(dimethylamino)quinolin-3-yl]methyl-[(4-methylphenyl)methyl]-(pyridin-4-ylmethyl)azanium Openeye Name: [2-(dimethylamino)-3-quinolyl]methyl-(p-tolylmethyl)-(4-pyridylmethyl)ammonium CAS Name: [2-(dimethylamino)-3-quinolinyl]methyl-[(4-methylphenyl)methyl]-(pyridin-4-ylmethyl)ammonium IUPAC Name: [2-(dimethylamino)quinolin-3-yl]methyl-[(4-methylphenyl)methyl]-(pyridin-4-ylmethyl)azanium Traditional Name: [2-(dimethylamino)-3-quinolyl]methyl-(4-methylbenzyl)-(4-pyridylmethyl)ammonium Formula: C26H29N4+ MolecularWeight: 397.53526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+](CC2=CC=NC=C2)CC3=CC4=CC=CC=C4N=C3N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+](CC2=CC=NC=C2)CC3=CC4=CC=CC=C4N=C3N(C)C

InChI

InChI=1S/C26H28N4/c1-20-8-10-21(11-9-20)17-30(18-22-12-14-27-15-13-22)19-24-16-23-6-4-5-7-25(23)28-26(24)29(2)3/h4-16H,17-19H2,1-3H3/p+1