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

Systemtic Name: (4-chlorophenyl) [2-(3-methyl-1,3-thiazol-3-ium-2-yl)phenyl] hydrogen phosphate Openeye Name: (4-chlorophenyl) [2-(3-methylthiazol-3-ium-2-yl)phenyl] hydrogen phosphate CAS Name: (4-chlorophenyl) [2-(3-methyl-2-thiazol-3-iumyl)phenyl] hydrogen phosphate IUPAC Name: (4-chlorophenyl) [2-(3-methyl-1,3-thiazol-3-ium-2-yl)phenyl] hydrogen phosphate Traditional Name: (4-chlorophenyl) [2-(3-methylthiazol-3-ium-2-yl)phenyl] hydrogen phosphate Formula: C16H14ClNO4PS+ MolecularWeight: 382.778421

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(SC=C1)C2=CC=CC=C2OP(=O)(O)OC3=CC=C(C=C3)Cl

Isomeric SMILES

C[N+]1=C(SC=C1)C2=CC=CC=C2OP(=O)(O)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H13ClNO4PS/c1-18-10-11-24-16(18)14-4-2-3-5-15(14)22-23(19,20)21-13-8-6-12(17)7-9-13/h2-11H,1H3/p+1