ethyl 5-(5-chloranyl-1-methyl-imidazol-4-yl)sulfonyloxy-2-methyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 5-(5-chloranyl-1-methyl-imidazol-4-yl)sulfonyloxy-2-methyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-(5-chloro-1-methyl-imidazol-4-yl)sulfonyloxy-2-methyl-benzofuran-3-carboxylate CAS Name: 5-[(5-chloro-1-methyl-4-imidazolyl)sulfonyloxy]-2-methyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-(5-chloro-1-methylimidazol-4-yl)sulfonyloxy-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 5-(5-chloro-1-methyl-imidazol-4-yl)sulfonyloxy-2-methyl-benzofuran-3-carboxylic acid ethyl ester Formula: C16H15ClN2O6S MolecularWeight: 398.8181

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OS(=O)(=O)C3=C(N(C=N3)C)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OS(=O)(=O)C3=C(N(C=N3)C)Cl)C

InChI

InChI=1S/C16H15ClN2O6S/c1-4-23-16(20)13-9(2)24-12-6-5-10(7-11(12)13)25-26(21,22)15-14(17)19(3)8-18-15/h5-8H,4H2,1-3H3