2-(1-ethylpiperidin-1-ium-1-yl)ethyl 2-(4-tetradecylidenecyclohexyl)oxyethyl hydrogen phosphate

Systemtic Name: 2-(1-ethylpiperidin-1-ium-1-yl)ethyl 2-(4-tetradecylidenecyclohexyl)oxyethyl hydrogen phosphate Openeye Name: 2-(1-ethylpiperidin-1-ium-1-yl)ethyl 2-(4-tetradecylidenecyclohexoxy)ethyl hydrogen phosphate CAS Name: 2-(1-ethyl-1-piperidin-1-iumyl)ethyl 2-(4-tetradecylidenecyclohexyl)oxyethyl hydrogen phosphate IUPAC Name: 2-(1-ethylpiperidin-1-ium-1-yl)ethyl 2-(4-tetradecylidenecyclohexyl)oxyethyl hydrogen phosphate Traditional Name: 2-(1-ethylpiperidin-1-ium-1-yl)ethyl 2-(4-tetradecylidenecyclohexoxy)ethyl hydrogen phosphate Formula: C31H61NO5P+ MolecularWeight: 558.793501

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC=C1CCC(CC1)OCCOP(=O)(O)OCC[N+]2(CCCCC2)CC

Isomeric SMILES

CCCCCCCCCCCCCC=C1CCC(CC1)OCCOP(=O)(O)OCC[N+]2(CCCCC2)CC

InChI

InChI=1S/C31H60NO5P/c1-3-5-6-7-8-9-10-11-12-13-14-16-19-30-20-22-31(23-21-30)35-28-29-37-38(33,34)36-27-26-32(4-2)24-17-15-18-25-32/h19,31H,3-18,20-29H2,1-2H3/p+1