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

Systemtic Name: [2-(3-methyl-1,3-thiazol-3-ium-2-yl)phenyl] (4-tetradecoxyphenyl) hydrogen phosphate Openeye Name: [2-(3-methylthiazol-3-ium-2-yl)phenyl] (4-tetradecoxyphenyl) hydrogen phosphate CAS Name: [2-(3-methyl-2-thiazol-3-iumyl)phenyl] (4-tetradecoxyphenyl) hydrogen phosphate IUPAC Name: [2-(3-methyl-1,3-thiazol-3-ium-2-yl)phenyl] (4-tetradecoxyphenyl) hydrogen phosphate Traditional Name: [2-(3-methylthiazol-3-ium-2-yl)phenyl] (4-myristyloxyphenyl) hydrogen phosphate Formula: C30H43NO5PS+ MolecularWeight: 560.704881

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC=C(C=C1)OP(=O)(O)OC2=CC=CC=C2C3=[N+](C=CS3)C

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC=C(C=C1)OP(=O)(O)OC2=CC=CC=C2C3=[N+](C=CS3)C

InChI

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