disodium [2-methoxy-5-[3-(3,4,5-trimethoxyphenyl)-1,2-thiazol-4-yl]phenyl] phosphate

Systemtic Name: disodium [2-methoxy-5-[3-(3,4,5-trimethoxyphenyl)-1,2-thiazol-4-yl]phenyl] phosphate Openeye Name: disodium [2-methoxy-5-[3-(3,4,5-trimethoxyphenyl)isothiazol-4-yl]phenyl] phosphate CAS Name: disodium [2-methoxy-5-[3-(3,4,5-trimethoxyphenyl)-4-isothiazolyl]phenyl] phosphate IUPAC Name: disodium [2-methoxy-5-[3-(3,4,5-trimethoxyphenyl)-1,2-thiazol-4-yl]phenyl] phosphate Traditional Name: disodium [2-methoxy-5-[3-(3,4,5-trimethoxyphenyl)isothiazol-4-yl]phenyl] phosphate Formula: C19H18NNa2O8PS MolecularWeight: 497.366421

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSN=C2C3=CC(=C(C(=C3)OC)OC)OC)OP(=O)([O-])[O-].[Na+].[Na+]

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSN=C2C3=CC(=C(C(=C3)OC)OC)OC)OP(=O)([O-])[O-].[Na+].[Na+]

InChI

InChI=1S/C19H20NO8PS.2Na/c1-24-14-6-5-11(7-15(14)28-29(21,22)23)13-10-30-20-18(13)12-8-16(25-2)19(27-4)17(9-12)26-3;;/h5-10H,1-4H3,(H2,21,22,23);;/q;2*+1/p-2