methyl 4-[(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)sulfamoyl]benzoate

Systemtic Name: methyl 4-[(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)sulfamoyl]benzoate Openeye Name: methyl 4-[(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)sulfamoyl]benzoate CAS Name: 4-[(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)sulfamoyl]benzoate Traditional Name: 4-[(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)sulfamoyl]benzoic acid methyl ester Formula: C17H16ClNO6S MolecularWeight: 397.83004

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2Cl)OCCCO3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2Cl)OCCCO3

InChI

InChI=1S/C17H16ClNO6S/c1-23-17(20)11-3-5-12(6-4-11)26(21,22)19-14-10-16-15(9-13(14)18)24-7-2-8-25-16/h3-6,9-10,19H,2,7-8H2,1H3