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

Systemtic Name: 4-methyl-3-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylsulfamoyl)benzoate Openeye Name: 4-methyl-3-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylsulfamoyl)benzoate CAS Name: 4-methyl-3-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]ylsulfamoyl)benzoate IUPAC Name: 4-methyl-3-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylsulfamoyl)benzoate Traditional Name: 4-methyl-3-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylsulfamoyl)benzoate Formula: C19H18NO6S- MolecularWeight: 388.41432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19NO6S/c1-12-4-5-13(18(21)22)10-17(12)27(23,24)20-14-6-7-15-16(11-14)26-19(25-15)8-2-3-9-19/h4-7,10-11,20H,2-3,8-9H2,1H3,(H,21,22)/p-1