ethyl 4-[2,3-dihydro-1,4-benzodioxin-6-yl(thiophen-2-ylmethyl)sulfamoyl]benzoate

Systemtic Name: ethyl 4-[2,3-dihydro-1,4-benzodioxin-6-yl(thiophen-2-ylmethyl)sulfamoyl]benzoate Openeye Name: ethyl 4-[2,3-dihydro-1,4-benzodioxin-6-yl(2-thienylmethyl)sulfamoyl]benzoate CAS Name: 4-[2,3-dihydro-1,4-benzodioxin-6-yl(thiophen-2-ylmethyl)sulfamoyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2,3-dihydro-1,4-benzodioxin-6-yl(thiophen-2-ylmethyl)sulfamoyl]benzoate Traditional Name: 4-[2,3-dihydro-1,4-benzodioxin-6-yl(2-thenyl)sulfamoyl]benzoic acid ethyl ester Formula: C22H21NO6S2 MolecularWeight: 459.53524

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CS2)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CS2)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H21NO6S2/c1-2-27-22(24)16-5-8-19(9-6-16)31(25,26)23(15-18-4-3-13-30-18)17-7-10-20-21(14-17)29-12-11-28-20/h3-10,13-14H,2,11-12,15H2,1H3