2-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)carbonylamino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)carbonylamino]-3-oxidanyl-propanoic acid Openeye Name: 2-[(5-chloro-2,3-dihydro-1,4-benzodioxine-7-carbonyl)amino]-3-hydroxy-propanoic acid CAS Name: 2-[[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-oxomethyl]amino]-3-hydroxypropanoic acid IUPAC Name: 2-[(5-chloro-2,3-dihydro-1,4-benzodioxine-7-carbonyl)amino]-3-hydroxypropanoic acid Traditional Name: 2-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-carbonyl)amino]-3-hydroxy-propionic acid Formula: C12H12ClNO6 MolecularWeight: 301.67978

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C=C2Cl)C(=O)NC(CO)C(=O)O

Isomeric SMILES

C1COC2=C(O1)C=C(C=C2Cl)C(=O)NC(CO)C(=O)O

InChI

InChI=1S/C12H12ClNO6/c13-7-3-6(4-9-10(7)20-2-1-19-9)11(16)14-8(5-15)12(17)18/h3-4,8,15H,1-2,5H2,(H,14,16)(H,17,18)