2-(3,4-dimethyl-1,3-thiazol-3-ium-5-yl)ethyl octadecyl hydrogen phosphate

Systemtic Name: 2-(3,4-dimethyl-1,3-thiazol-3-ium-5-yl)ethyl octadecyl hydrogen phosphate Openeye Name: 2-(3,4-dimethylthiazol-3-ium-5-yl)ethyl octadecyl hydrogen phosphate CAS Name: 2-(3,4-dimethyl-5-thiazol-3-iumyl)ethyl octadecyl hydrogen phosphate IUPAC Name: 2-(3,4-dimethyl-1,3-thiazol-3-ium-5-yl)ethyl octadecyl hydrogen phosphate Traditional Name: 2-(3,4-dimethylthiazol-3-ium-5-yl)ethyl stearyl hydrogen phosphate Formula: C25H49NO4PS+ MolecularWeight: 490.699621

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOP(=O)(O)OCCC1=C([N+](=CS1)C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOP(=O)(O)OCCC1=C([N+](=CS1)C)C

InChI

InChI=1S/C25H48NO4PS/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-29-31(27,28)30-22-20-25-24(2)26(3)23-32-25/h23H,4-22H2,1-3H3/p+1