(2S)-2-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]carbonylamino]-3-oxidanyl-propanoate

Systemtic Name: (2S)-2-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]carbonylamino]-3-oxidanyl-propanoate Openeye Name: (2S)-2-[[(3R)-2,3-dihydro-1,4-benzodioxine-3-carbonyl]amino]-3-hydroxy-propanoate CAS Name: (2S)-2-[[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-oxomethyl]amino]-3-hydroxypropanoate IUPAC Name: (2S)-2-[[(3R)-2,3-dihydro-1,4-benzodioxine-3-carbonyl]amino]-3-hydroxypropanoate Traditional Name: (2S)-2-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-carbonyl]amino]-3-hydroxy-propionate Formula: C12H12NO6- MolecularWeight: 266.22678

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)C(=O)NC(CO)C(=O)[O-]

Isomeric SMILES

C1[C@@H](OC2=CC=CC=C2O1)C(=O)N[C@@H](CO)C(=O)[O-]

InChI

InChI=1S/C12H13NO6/c14-5-7(12(16)17)13-11(15)10-6-18-8-3-1-2-4-9(8)19-10/h1-4,7,10,14H,5-6H2,(H,13,15)(H,16,17)/p-1/t7-,10+/m0/s1