1-[1-(4-hexadecyloxolan-2-yl)-7-methoxy-heptyl]pyridin-1-ium

Systemtic Name: 1-[1-(4-hexadecyloxolan-2-yl)-7-methoxy-heptyl]pyridin-1-ium Openeye Name: 1-[1-(4-hexadecyltetrahydrofuran-2-yl)-7-methoxy-heptyl]pyridin-1-ium CAS Name: 1-[1-(4-hexadecyl-2-oxolanyl)-7-methoxyheptyl]pyridin-1-ium IUPAC Name: 1-[1-(4-hexadecyloxolan-2-yl)-7-methoxyheptyl]pyridin-1-ium Traditional Name: 1-[1-(4-cetyltetrahydrofuran-2-yl)-7-methoxy-heptyl]pyridin-1-ium Formula: C33H60NO2+ MolecularWeight: 502.835

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC1CC(OC1)C(CCCCCCOC)[N+]2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCCC1CC(OC1)C(CCCCCCOC)[N+]2=CC=CC=C2

InChI

InChI=1S/C33H60NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-24-31-29-33(36-30-31)32(34-26-21-18-22-27-34)25-20-16-17-23-28-35-2/h18,21-22,26-27,31-33H,3-17,19-20,23-25,28-30H2,1-2H3/q+1