3,4-dimethyl-5-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylsulfamoyl)benzoate

Systemtic Name: 3,4-dimethyl-5-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylsulfamoyl)benzoate Openeye Name: 3,4-dimethyl-5-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylsulfamoyl)benzoate CAS Name: 3,4-dimethyl-5-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]ylsulfamoyl)benzoate IUPAC Name: 3,4-dimethyl-5-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylsulfamoyl)benzoate Traditional Name: 3,4-dimethyl-5-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylsulfamoyl)benzoate Formula: C20H20NO6S- MolecularWeight: 402.4409

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)[O-])S(=O)(=O)NC2=CC3=C(C=C2)OC4(O3)CCCC4)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)[O-])S(=O)(=O)NC2=CC3=C(C=C2)OC4(O3)CCCC4)C

InChI

InChI=1S/C20H21NO6S/c1-12-9-14(19(22)23)10-18(13(12)2)28(24,25)21-15-5-6-16-17(11-15)27-20(26-16)7-3-4-8-20/h5-6,9-11,21H,3-4,7-8H2,1-2H3,(H,22,23)/p-1