[2-(3,5-dimethyl-1,3-thiazol-3-ium-2-yl)phenyl] (4-tetradecoxyphenyl) hydrogen phosphate

Systemtic Name: [2-(3,5-dimethyl-1,3-thiazol-3-ium-2-yl)phenyl] (4-tetradecoxyphenyl) hydrogen phosphate Openeye Name: [2-(3,5-dimethylthiazol-3-ium-2-yl)phenyl] (4-tetradecoxyphenyl) hydrogen phosphate CAS Name: [2-(3,5-dimethyl-2-thiazol-3-iumyl)phenyl] (4-tetradecoxyphenyl) hydrogen phosphate IUPAC Name: [2-(3,5-dimethyl-1,3-thiazol-3-ium-2-yl)phenyl] (4-tetradecoxyphenyl) hydrogen phosphate Traditional Name: [2-(3,5-dimethylthiazol-3-ium-2-yl)phenyl] (4-myristyloxyphenyl) hydrogen phosphate Formula: C31H45NO5PS+ MolecularWeight: 574.731461

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC=C(C=C1)OP(=O)(O)OC2=CC=CC=C2C3=[N+](C=C(S3)C)C

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC=C(C=C1)OP(=O)(O)OC2=CC=CC=C2C3=[N+](C=C(S3)C)C

InChI

InChI=1S/C31H44NO5PS/c1-4-5-6-7-8-9-10-11-12-13-14-17-24-35-27-20-22-28(23-21-27)36-38(33,34)37-30-19-16-15-18-29(30)31-32(3)25-26(2)39-31/h15-16,18-23,25H,4-14,17,24H2,1-3H3/p+1