1-[2-(2-ethylhexoxy)-2-(4-hexylphenyl)ethyl]pyridin-1-ium

Systemtic Name: 1-[2-(2-ethylhexoxy)-2-(4-hexylphenyl)ethyl]pyridin-1-ium Openeye Name: 1-[2-(2-ethylhexoxy)-2-(4-hexylphenyl)ethyl]pyridin-1-ium CAS Name: 1-[2-(2-ethylhexoxy)-2-(4-hexylphenyl)ethyl]pyridin-1-ium IUPAC Name: 1-[2-(2-ethylhexoxy)-2-(4-hexylphenyl)ethyl]pyridin-1-ium Traditional Name: 1-[2-(2-ethylhexoxy)-2-(4-hexylphenyl)ethyl]pyridin-1-ium Formula: C27H42NO+ MolecularWeight: 396.62848

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(C[N+]2=CC=CC=C2)OCC(CC)CCCC

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(C[N+]2=CC=CC=C2)OCC(CC)CCCC

InChI

InChI=1S/C27H42NO/c1-4-7-9-11-15-25-16-18-26(19-17-25)27(22-28-20-12-10-13-21-28)29-23-24(6-3)14-8-5-2/h10,12-13,16-21,24,27H,4-9,11,14-15,22-23H2,1-3H3/q+1