5-oxidanyl-2-(2,3,4,5-tetrahydro-1,6-benzodioxocin-8-ylcarbonylamino)benzoic acid

Systemtic Name: 5-oxidanyl-2-(2,3,4,5-tetrahydro-1,6-benzodioxocin-8-ylcarbonylamino)benzoic acid Openeye Name: 5-hydroxy-2-(2,3,4,5-tetrahydro-1,6-benzodioxocine-8-carbonylamino)benzoic acid CAS Name: 5-hydroxy-2-[[oxo(2,3,4,5-tetrahydro-1,6-benzodioxocin-8-yl)methyl]amino]benzoic acid IUPAC Name: 5-hydroxy-2-(2,3,4,5-tetrahydro-1,6-benzodioxocine-8-carbonylamino)benzoic acid Traditional Name: 5-hydroxy-2-(2,3,4,5-tetrahydro-1,6-benzodioxocin-8-carbonylamino)benzoic acid Formula: C18H17NO6 MolecularWeight: 343.33068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCOC2=C(C=CC(=C2)C(=O)NC3=C(C=C(C=C3)O)C(=O)O)OC1

Isomeric SMILES

C1CCOC2=C(C=CC(=C2)C(=O)NC3=C(C=C(C=C3)O)C(=O)O)OC1

InChI

InChI=1S/C18H17NO6/c20-12-4-5-14(13(10-12)18(22)23)19-17(21)11-3-6-15-16(9-11)25-8-2-1-7-24-15/h3-6,9-10,20H,1-2,7-8H2,(H,19,21)(H,22,23)