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

Systemtic Name: [2-(3-methyl-1,3-thiazol-3-ium-2-yl)phenyl] (2-tetradecoxyphenyl) hydrogen phosphate Openeye Name: [2-(3-methylthiazol-3-ium-2-yl)phenyl] (2-tetradecoxyphenyl) hydrogen phosphate CAS Name: [2-(3-methyl-2-thiazol-3-iumyl)phenyl] (2-tetradecoxyphenyl) hydrogen phosphate IUPAC Name: [2-(3-methyl-1,3-thiazol-3-ium-2-yl)phenyl] (2-tetradecoxyphenyl) hydrogen phosphate Traditional Name: [2-(3-methylthiazol-3-ium-2-yl)phenyl] (2-myristyloxyphenyl) hydrogen phosphate Formula: C30H43NO5PS+ MolecularWeight: 560.704881

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC=CC=C1OP(=O)(O)OC2=CC=CC=C2C3=[N+](C=CS3)C

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC=CC=C1OP(=O)(O)OC2=CC=CC=C2C3=[N+](C=CS3)C

InChI

InChI=1S/C30H42NO5PS/c1-3-4-5-6-7-8-9-10-11-12-13-18-24-34-28-21-16-17-22-29(28)36-37(32,33)35-27-20-15-14-19-26(27)30-31(2)23-25-38-30/h14-17,19-23,25H,3-13,18,24H2,1-2H3/p+1