4-[2-[2,4-bis(4-ethoxyphenyl)-6-methyl-pyridin-1-ium-1-yl]ethyl]morpholin-4-ium

Systemtic Name: 4-[2-[2,4-bis(4-ethoxyphenyl)-6-methyl-pyridin-1-ium-1-yl]ethyl]morpholin-4-ium Openeye Name: 4-[2-[2,4-bis(4-ethoxyphenyl)-6-methyl-pyridin-1-ium-1-yl]ethyl]morpholin-4-ium CAS Name: 4-[2-[2,4-bis(4-ethoxyphenyl)-6-methyl-1-pyridin-1-iumyl]ethyl]morpholin-4-ium IUPAC Name: 4-[2-[2,4-bis(4-ethoxyphenyl)-6-methylpyridin-1-ium-1-yl]ethyl]morpholin-4-ium Traditional Name: 4-[2-[2-methyl-4,6-bis(p-phenetyl)pyridin-1-ium-1-yl]ethyl]morpholin-4-ium Formula: C28H36N2O3+2 MolecularWeight: 448.59704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CC(=[N+](C(=C2)C)CC[NH+]3CCOCC3)C4=CC=C(C=C4)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CC(=[N+](C(=C2)C)CC[NH+]3CCOCC3)C4=CC=C(C=C4)OCC

InChI

InChI=1S/C28H35N2O3/c1-4-32-26-10-6-23(7-11-26)25-20-22(3)30(15-14-29-16-18-31-19-17-29)28(21-25)24-8-12-27(13-9-24)33-5-2/h6-13,20-21H,4-5,14-19H2,1-3H3/q+1/p+1