methyl 3-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylsulfamoyl]thiophene-2-carboxylate

Systemtic Name: methyl 3-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylsulfamoyl]thiophene-2-carboxylate Openeye Name: methyl 3-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylsulfamoyl]thiophene-2-carboxylate CAS Name: 3-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylsulfamoyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylsulfamoyl]thiophene-2-carboxylate Traditional Name: 3-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylsulfamoyl]thiophene-2-carboxylic acid methyl ester Formula: C16H16ClNO6S2 MolecularWeight: 417.88434

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)S(=O)(=O)NCC2=CC3=C(C(=C2)Cl)OCCCO3

Isomeric SMILES

COC(=O)C1=C(C=CS1)S(=O)(=O)NCC2=CC3=C(C(=C2)Cl)OCCCO3

InChI

InChI=1S/C16H16ClNO6S2/c1-22-16(19)15-13(3-6-25-15)26(20,21)18-9-10-7-11(17)14-12(8-10)23-4-2-5-24-14/h3,6-8,18H,2,4-5,9H2,1H3