2-(2,3-dihydro-1,4-benzodioxin-5-ylcarbonylamino)-3-oxidanyl-butanoic acid

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-5-ylcarbonylamino)-3-oxidanyl-butanoic acid Openeye Name: 2-(2,3-dihydro-1,4-benzodioxine-5-carbonylamino)-3-hydroxy-butanoic acid CAS Name: 2-[[2,3-dihydro-1,4-benzodioxin-5-yl(oxo)methyl]amino]-3-hydroxybutanoic acid IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxine-5-carbonylamino)-3-hydroxybutanoic acid Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-5-carbonylamino)-3-hydroxy-butyric acid Formula: C13H15NO6 MolecularWeight: 281.2613

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)NC(=O)C1=C2C(=CC=C1)OCCO2)O

Isomeric SMILES

CC(C(C(=O)O)NC(=O)C1=C2C(=CC=C1)OCCO2)O

InChI

InChI=1S/C13H15NO6/c1-7(15)10(13(17)18)14-12(16)8-3-2-4-9-11(8)20-6-5-19-9/h2-4,7,10,15H,5-6H2,1H3,(H,14,16)(H,17,18)