1-[2-[2-(3-octadecoxy-2-pyrimidin-4-yloxy-propoxy)ethoxy]ethyl]pyridin-1-ium-3-carboxamide

Systemtic Name: 1-[2-[2-(3-octadecoxy-2-pyrimidin-4-yloxy-propoxy)ethoxy]ethyl]pyridin-1-ium-3-carboxamide Openeye Name: 1-[2-[2-(3-octadecoxy-2-pyrimidin-4-yloxy-propoxy)ethoxy]ethyl]pyridin-1-ium-3-carboxamide CAS Name: 1-[2-[2-[3-octadecoxy-2-(4-pyrimidinyloxy)propoxy]ethoxy]ethyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 1-[2-[2-(3-octadecoxy-2-pyrimidin-4-yloxypropoxy)ethoxy]ethyl]pyridin-1-ium-3-carboxamide Traditional Name: 1-[2-[2-[2-(4-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=NC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(COCCOCC[N+]1=CC=CC(=C1)C(=O)N)OC2=NC=NC=C2

InChI

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