(3-ethyl-5-methyl-2-phenyl-1,3-thiazol-3-ium-4-yl) (2-methoxy-3-tetradecoxy-phenyl) hydrogen phosphate

Systemtic Name: (3-ethyl-5-methyl-2-phenyl-1,3-thiazol-3-ium-4-yl) (2-methoxy-3-tetradecoxy-phenyl) hydrogen phosphate Openeye Name: (3-ethyl-5-methyl-2-phenyl-thiazol-3-ium-4-yl) (2-methoxy-3-tetradecoxy-phenyl) hydrogen phosphate CAS Name: (3-ethyl-5-methyl-2-phenyl-4-thiazol-3-iumyl) (2-methoxy-3-tetradecoxyphenyl) hydrogen phosphate IUPAC Name: (3-ethyl-5-methyl-2-phenyl-1,3-thiazol-3-ium-4-yl) (2-methoxy-3-tetradecoxyphenyl) hydrogen phosphate Traditional Name: (3-ethyl-5-methyl-2-phenyl-thiazol-3-ium-4-yl) (2-methoxy-3-myristyloxy-phenyl) hydrogen phosphate Formula: C33H49NO6PS+ MolecularWeight: 618.784021

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C(=CC=C1)OP(=O)(O)OC2=C(SC(=[N+]2CC)C3=CC=CC=C3)C)OC

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C(=CC=C1)OP(=O)(O)OC2=C(SC(=[N+]2CC)C3=CC=CC=C3)C)OC

InChI

InChI=1S/C33H48NO6PS/c1-5-7-8-9-10-11-12-13-14-15-16-20-26-38-29-24-21-25-30(31(29)37-4)39-41(35,36)40-32-27(3)42-33(34(32)6-2)28-22-18-17-19-23-28/h17-19,21-25H,5-16,20,26H2,1-4H3/p+1