4-[[(2,2-dimethyl-4H-1,3-benzodioxin-6-yl)sulfonylamino]methyl]benzoic acid

Systemtic Name: 4-[[(2,2-dimethyl-4H-1,3-benzodioxin-6-yl)sulfonylamino]methyl]benzoic acid Openeye Name: 4-[[(2,2-dimethyl-4H-1,3-benzodioxin-6-yl)sulfonylamino]methyl]benzoic acid CAS Name: 4-[[(2,2-dimethyl-4H-1,3-benzodioxin-6-yl)sulfonylamino]methyl]benzoic acid IUPAC Name: 4-[[(2,2-dimethyl-4H-1,3-benzodioxin-6-yl)sulfonylamino]methyl]benzoic acid Traditional Name: 4-[[(2,2-dimethyl-4H-1,3-benzodioxin-6-yl)sulfonylamino]methyl]benzoic acid Formula: C18H19NO6S MolecularWeight: 377.41156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC2=C(O1)C=CC(=C2)S(=O)(=O)NCC3=CC=C(C=C3)C(=O)O)C

Isomeric SMILES

CC1(OCC2=C(O1)C=CC(=C2)S(=O)(=O)NCC3=CC=C(C=C3)C(=O)O)C

InChI

InChI=1S/C18H19NO6S/c1-18(2)24-11-14-9-15(7-8-16(14)25-18)26(22,23)19-10-12-3-5-13(6-4-12)17(20)21/h3-9,19H,10-11H2,1-2H3,(H,20,21)