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

Systemtic Name: [2-(3,4-dimethyl-1,3-thiazol-3-ium-2-yl)phenyl] (2-dodecoxy-5-methoxy-phenyl) hydrogen phosphate Openeye Name: [2-(3,4-dimethylthiazol-3-ium-2-yl)phenyl] (2-dodecoxy-5-methoxy-phenyl) hydrogen phosphate CAS Name: [2-(3,4-dimethyl-2-thiazol-3-iumyl)phenyl] (2-dodecoxy-5-methoxyphenyl) hydrogen phosphate IUPAC Name: [2-(3,4-dimethyl-1,3-thiazol-3-ium-2-yl)phenyl] (2-dodecoxy-5-methoxyphenyl) hydrogen phosphate Traditional Name: [2-(3,4-dimethylthiazol-3-ium-2-yl)phenyl] (2-lauryloxy-5-methoxy-phenyl) hydrogen phosphate Formula: C30H43NO6PS+ MolecularWeight: 576.704281

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=C(C=C(C=C1)OC)OP(=O)(O)OC2=CC=CC=C2C3=[N+](C(=CS3)C)C

Isomeric SMILES

CCCCCCCCCCCCOC1=C(C=C(C=C1)OC)OP(=O)(O)OC2=CC=CC=C2C3=[N+](C(=CS3)C)C

InChI

InChI=1S/C30H42NO6PS/c1-5-6-7-8-9-10-11-12-13-16-21-35-28-20-19-25(34-4)22-29(28)37-38(32,33)36-27-18-15-14-17-26(27)30-31(3)24(2)23-39-30/h14-15,17-20,22-23H,5-13,16,21H2,1-4H3/p+1