1-[2-butoxy-2-(4-octylphenyl)ethyl]pyridin-1-ium

Systemtic Name: 1-[2-butoxy-2-(4-octylphenyl)ethyl]pyridin-1-ium Openeye Name: 1-[2-butoxy-2-(4-octylphenyl)ethyl]pyridin-1-ium CAS Name: 1-[2-butoxy-2-(4-octylphenyl)ethyl]pyridin-1-ium IUPAC Name: 1-[2-butoxy-2-(4-octylphenyl)ethyl]pyridin-1-ium Traditional Name: 1-[2-butoxy-2-(4-octylphenyl)ethyl]pyridin-1-ium Formula: C25H38NO+ MolecularWeight: 368.57532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C(C[N+]2=CC=CC=C2)OCCCC

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C(C[N+]2=CC=CC=C2)OCCCC

InChI

InChI=1S/C25H38NO/c1-3-5-7-8-9-11-14-23-15-17-24(18-16-23)25(27-21-6-4-2)22-26-19-12-10-13-20-26/h10,12-13,15-20,25H,3-9,11,14,21-22H2,1-2H3/q+1