(4-phenylmethoxyphenyl) 5-chloranyl-1-methyl-imidazole-4-sulfonate

Systemtic Name: (4-phenylmethoxyphenyl) 5-chloranyl-1-methyl-imidazole-4-sulfonate Openeye Name: (4-benzyloxyphenyl) 5-chloro-1-methyl-imidazole-4-sulfonate CAS Name: 5-chloro-1-methyl-4-imidazolesulfonic acid (4-phenylmethoxyphenyl) ester IUPAC Name: (4-phenylmethoxyphenyl) 5-chloro-1-methylimidazole-4-sulfonate Traditional Name: 5-chloro-1-methyl-imidazole-4-sulfonic acid (4-benzoxyphenyl) ester Formula: C17H15ClN2O4S MolecularWeight: 378.83

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1Cl)S(=O)(=O)OC2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

CN1C=NC(=C1Cl)S(=O)(=O)OC2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C17H15ClN2O4S/c1-20-12-19-17(16(20)18)25(21,22)24-15-9-7-14(8-10-15)23-11-13-5-3-2-4-6-13/h2-10,12H,11H2,1H3