2-(6-methylpyridin-2-yl)-1,3-bis(phenylmethyl)-1,3-diazinane-1,3-diium

Systemtic Name: 2-(6-methylpyridin-2-yl)-1,3-bis(phenylmethyl)-1,3-diazinane-1,3-diium Openeye Name: 1,3-dibenzyl-2-(6-methyl-2-pyridyl)hexahydropyrimidine-1,3-diium CAS Name: 2-(6-methyl-2-pyridinyl)-1,3-bis(phenylmethyl)-1,3-diazinane-1,3-diium IUPAC Name: 1,3-dibenzyl-2-(6-methylpyridin-2-yl)-1,3-diazinane-1,3-diium Traditional Name: 1,3-dibenzyl-2-(6-methyl-2-pyridyl)hexahydropyrimidine-1,3-diium Formula: C24H29N3+2 MolecularWeight: 359.50716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=N1)C2[NH+](CCC[NH+]2CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC(=N1)C2[NH+](CCC[NH+]2CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C24H27N3/c1-20-10-8-15-23(25-20)24-26(18-21-11-4-2-5-12-21)16-9-17-27(24)19-22-13-6-3-7-14-22/h2-8,10-15,24H,9,16-19H2,1H3/p+2