2-(2-pentadecoxyethoxy)ethyl 2-pyridin-1-ium-1-ylethyl phosphate

Systemtic Name: 2-(2-pentadecoxyethoxy)ethyl 2-pyridin-1-ium-1-ylethyl phosphate Openeye Name: 2-(2-pentadecoxyethoxy)ethyl 2-pyridin-1-ium-1-ylethyl phosphate CAS Name: 2-(2-pentadecoxyethoxy)ethyl 2-(1-pyridin-1-iumyl)ethyl phosphate IUPAC Name: 2-(2-pentadecoxyethoxy)ethyl 2-pyridin-1-ium-1-ylethyl phosphate Traditional Name: 2-(2-pentadecoxyethoxy)ethyl 2-pyridin-1-ium-1-ylethyl phosphate Formula: C26H48NO6P MolecularWeight: 501.636181

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCOCCOCCOP(=O)([O-])OCC[N+]1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCOCCOCCOP(=O)([O-])OCC[N+]1=CC=CC=C1

InChI

InChI=1S/C26H48NO6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-21-30-23-24-31-25-26-33-34(28,29)32-22-20-27-18-15-14-16-19-27/h14-16,18-19H,2-13,17,20-26H2,1H3