N-[4-[(3-chloranyl-4-methyl-phenyl)sulfamoyl]phenyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-[4-[(3-chloranyl-4-methyl-phenyl)sulfamoyl]phenyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-[4-[(3-chloro-4-methyl-phenyl)sulfamoyl]phenyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[4-[(3-chloro-4-methylphenyl)sulfamoyl]phenyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-[4-[(3-chloro-4-methylphenyl)sulfamoyl]phenyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-[4-[(3-chloro-4-methyl-phenyl)sulfamoyl]phenyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C21H19ClN2O6S2 MolecularWeight: 494.96836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCO4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCO4)Cl

InChI

InChI=1S/C21H19ClN2O6S2/c1-14-2-3-16(12-19(14)22)24-31(25,26)17-6-4-15(5-7-17)23-32(27,28)18-8-9-20-21(13-18)30-11-10-29-20/h2-9,12-13,23-24H,10-11H2,1H3