1-[1-(2-heptadecyl-1,3-dioxolan-4-yl)-6-methoxy-hexyl]quinolin-1-ium

Systemtic Name: 1-[1-(2-heptadecyl-1,3-dioxolan-4-yl)-6-methoxy-hexyl]quinolin-1-ium Openeye Name: 1-[1-(2-heptadecyl-1,3-dioxolan-4-yl)-6-methoxy-hexyl]quinolin-1-ium CAS Name: 1-[1-(2-heptadecyl-1,3-dioxolan-4-yl)-6-methoxyhexyl]quinolin-1-ium IUPAC Name: 1-[1-(2-heptadecyl-1,3-dioxolan-4-yl)-6-methoxyhexyl]quinolin-1-ium Traditional Name: 1-[1-(2-heptadecyl-1,3-dioxolan-4-yl)-6-methoxy-hexyl]quinolin-1-ium Formula: C36H60NO3+ MolecularWeight: 554.8665

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1OCC(O1)C(CCCCCOC)[N+]2=CC=CC3=CC=CC=C32

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1OCC(O1)C(CCCCCOC)[N+]2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C36H60NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-28-36-39-31-35(40-36)34(27-18-17-22-30-38-2)37-29-23-25-32-24-20-21-26-33(32)37/h20-21,23-26,29,34-36H,3-19,22,27-28,30-31H2,1-2H3/q+1