4-[(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)sulfamoyl]butanoic acid

Systemtic Name: 4-[(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)sulfamoyl]butanoic acid Openeye Name: 4-[(6-chlorothiochroman-4-yl)sulfamoyl]butanoic acid CAS Name: 4-[(6-chloro-3,4-dihydro-2H-1-benzothiopyran-4-yl)sulfamoyl]butanoic acid IUPAC Name: 4-[(6-chloro-3,4-dihydro-2H-thiochromen-4-yl)sulfamoyl]butanoic acid Traditional Name: 4-[(6-chlorothiochroman-4-yl)sulfamoyl]butyric acid Formula: C13H16ClNO4S2 MolecularWeight: 349.85344

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C1NS(=O)(=O)CCCC(=O)O)C=C(C=C2)Cl

Isomeric SMILES

C1CSC2=C(C1NS(=O)(=O)CCCC(=O)O)C=C(C=C2)Cl

InChI

InChI=1S/C13H16ClNO4S2/c14-9-3-4-12-10(8-9)11(5-6-20-12)15-21(18,19)7-1-2-13(16)17/h3-4,8,11,15H,1-2,5-7H2,(H,16,17)