1,3-bis[(4-methoxyphenyl)methyl]-2-pyridin-3-yl-1,3-diazinane-1,3-diium

Systemtic Name: 1,3-bis[(4-methoxyphenyl)methyl]-2-pyridin-3-yl-1,3-diazinane-1,3-diium Openeye Name: 1,3-bis[(4-methoxyphenyl)methyl]-2-(3-pyridyl)hexahydropyrimidine-1,3-diium CAS Name: 1,3-bis[(4-methoxyphenyl)methyl]-2-(3-pyridinyl)-1,3-diazinane-1,3-diium IUPAC Name: 1,3-bis[(4-methoxyphenyl)methyl]-2-pyridin-3-yl-1,3-diazinane-1,3-diium Traditional Name: 1,3-bis(p-anisyl)-2-(3-pyridyl)hexahydropyrimidine-1,3-diium Formula: C25H31N3O2+2 MolecularWeight: 405.53254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH+]2CCC[NH+](C2C3=CN=CC=C3)CC4=CC=C(C=C4)OC

Isomeric SMILES

COC1=CC=C(C=C1)C[NH+]2CCC[NH+](C2C3=CN=CC=C3)CC4=CC=C(C=C4)OC

InChI

InChI=1S/C25H29N3O2/c1-29-23-10-6-20(7-11-23)18-27-15-4-16-28(25(27)22-5-3-14-26-17-22)19-21-8-12-24(30-2)13-9-21/h3,5-14,17,25H,4,15-16,18-19H2,1-2H3/p+2