4-[[(2R)-2-(3-hydroxyphenyl)-2-oxidanyl-ethyl]-methyl-amino]-2-oxidanyl-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[(2R)-2-(3-hydroxyphenyl)-2-oxidanyl-ethyl]-methyl-amino]-2-oxidanyl-4-oxidanylidene-butanoic acid Openeye Name: 2-hydroxy-4-[[(2R)-2-hydroxy-2-(3-hydroxyphenyl)ethyl]-methyl-amino]-4-oxo-butanoic acid CAS Name: 2-hydroxy-4-[[(2R)-2-hydroxy-2-(3-hydroxyphenyl)ethyl]-methylamino]-4-oxobutanoic acid IUPAC Name: 2-hydroxy-4-[[(2R)-2-hydroxy-2-(3-hydroxyphenyl)ethyl]-methylamino]-4-oxobutanoic acid Traditional Name: 2-hydroxy-4-[[(2R)-2-hydroxy-2-(3-hydroxyphenyl)ethyl]-methyl-amino]-4-keto-butyric acid Formula: C13H17NO6 MolecularWeight: 283.27718

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(C1=CC(=CC=C1)O)O)C(=O)CC(C(=O)O)O

Isomeric SMILES

CN(C[C@@H](C1=CC(=CC=C1)O)O)C(=O)CC(C(=O)O)O

InChI

InChI=1S/C13H17NO6/c1-14(12(18)6-10(16)13(19)20)7-11(17)8-3-2-4-9(15)5-8/h2-5,10-11,15-17H,6-7H2,1H3,(H,19,20)/t10?,11-/m0/s1