5-cyclopentadecylpentyl 2-(1-methylpiperidin-1-ium-1-yl)ethyl hydrogen phosphate

Systemtic Name: 5-cyclopentadecylpentyl 2-(1-methylpiperidin-1-ium-1-yl)ethyl hydrogen phosphate Openeye Name: 5-cyclopentadecylpentyl 2-(1-methylpiperidin-1-ium-1-yl)ethyl hydrogen phosphate CAS Name: 5-cyclopentadecylpentyl 2-(1-methyl-1-piperidin-1-iumyl)ethyl hydrogen phosphate IUPAC Name: 5-cyclopentadecylpentyl 2-(1-methylpiperidin-1-ium-1-yl)ethyl hydrogen phosphate Traditional Name: 5-cyclopentadecylpentyl 2-(1-methylpiperidin-1-ium-1-yl)ethyl hydrogen phosphate Formula: C28H57NO4P+ MolecularWeight: 502.730241

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1)CCOP(=O)(O)OCCCCCC2CCCCCCCCCCCCCC2

Isomeric SMILES

C[N+]1(CCCCC1)CCOP(=O)(O)OCCCCCC2CCCCCCCCCCCCCC2

InChI

InChI=1S/C28H56NO4P/c1-29(23-17-13-18-24-29)25-27-33-34(30,31)32-26-19-12-16-22-28-20-14-10-8-6-4-2-3-5-7-9-11-15-21-28/h28H,2-27H2,1H3/p+1