1-[3-(2,4-dipentylphenoxy)propyl]-4-methyl-pyridin-1-ium

Systemtic Name: 1-[3-(2,4-dipentylphenoxy)propyl]-4-methyl-pyridin-1-ium Openeye Name: 1-[3-(2,4-dipentylphenoxy)propyl]-4-methyl-pyridin-1-ium CAS Name: 1-[3-(2,4-dipentylphenoxy)propyl]-4-methylpyridin-1-ium IUPAC Name: 1-[3-(2,4-dipentylphenoxy)propyl]-4-methylpyridin-1-ium Traditional Name: 1-[3-(2,4-diamylphenoxy)propyl]-4-methyl-pyridin-1-ium Formula: C25H38NO+ MolecularWeight: 368.57532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(C=C1)OCCC[N+]2=CC=C(C=C2)C)CCCCC

Isomeric SMILES

CCCCCC1=CC(=C(C=C1)OCCC[N+]2=CC=C(C=C2)C)CCCCC

InChI

InChI=1S/C25H38NO/c1-4-6-8-11-23-13-14-25(24(21-23)12-9-7-5-2)27-20-10-17-26-18-15-22(3)16-19-26/h13-16,18-19,21H,4-12,17,20H2,1-3H3/q+1