1-[2-[2-(3-octadecoxy-2-pyrimidin-2-yloxy-propoxy)ethoxy]ethyl]pyridin-1-ium-3-carboxamide

Systemtic Name: 1-[2-[2-(3-octadecoxy-2-pyrimidin-2-yloxy-propoxy)ethoxy]ethyl]pyridin-1-ium-3-carboxamide Openeye Name: 1-[2-[2-(3-octadecoxy-2-pyrimidin-2-yloxy-propoxy)ethoxy]ethyl]pyridin-1-ium-3-carboxamide CAS Name: 1-[2-[2-[3-octadecoxy-2-(2-pyrimidinyloxy)propoxy]ethoxy]ethyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 1-[2-[2-(3-octadecoxy-2-pyrimidin-2-yloxypropoxy)ethoxy]ethyl]pyridin-1-ium-3-carboxamide Traditional Name: 1-[2-[2-[2-(2-pyrimidyloxy)-3-stearyloxy-propoxy]ethoxy]ethyl]pyridin-1-ium-3-carboxamide Formula: C35H59N4O5+ MolecularWeight: 615.86676

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(COCCOCC[N+]1=CC=CC(=C1)C(=O)N)OC2=NC=CC=N2

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(COCCOCC[N+]1=CC=CC(=C1)C(=O)N)OC2=NC=CC=N2

InChI

InChI=1S/C35H58N4O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25-42-30-33(44-35-37-21-19-22-38-35)31-43-28-27-41-26-24-39-23-18-20-32(29-39)34(36)40/h18-23,29,33H,2-17,24-28,30-31H2,1H3,(H-,36,40)/p+1