[3-[(5-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl] (3-phenyl-4-tetradecoxy-phenyl) hydrogen phosphate

Systemtic Name: [3-[(5-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl] (3-phenyl-4-tetradecoxy-phenyl) hydrogen phosphate Openeye Name: [3-[(5-methylthiazol-3-ium-3-yl)methyl]phenyl] (3-phenyl-4-tetradecoxy-phenyl) hydrogen phosphate CAS Name: [3-[(5-methyl-3-thiazol-3-iumyl)methyl]phenyl] (3-phenyl-4-tetradecoxyphenyl) hydrogen phosphate IUPAC Name: [3-[(5-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl] (3-phenyl-4-tetradecoxyphenyl) hydrogen phosphate Traditional Name: [3-[(5-methylthiazol-3-ium-3-yl)methyl]phenyl] (4-myristyloxy-3-phenyl-phenyl) hydrogen phosphate Formula: C37H49NO5PS+ MolecularWeight: 650.827421

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)OP(=O)(O)OC2=CC=CC(=C2)C[N+]3=CSC(=C3)C)C4=CC=CC=C4

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)OP(=O)(O)OC2=CC=CC(=C2)C[N+]3=CSC(=C3)C)C4=CC=CC=C4

InChI

InChI=1S/C37H48NO5PS/c1-3-4-5-6-7-8-9-10-11-12-13-17-25-41-37-24-23-35(27-36(37)33-20-15-14-16-21-33)43-44(39,40)42-34-22-18-19-32(26-34)29-38-28-31(2)45-30-38/h14-16,18-24,26-28,30H,3-13,17,25,29H2,1-2H3/p+1