2-[carboxymethyl-[[5-(hydroxymethyl)-2-methyl-3-oxidanyl-pyridin-4-yl]methyl]amino]ethanoic acid

Systemtic Name: 2-[carboxymethyl-[[5-(hydroxymethyl)-2-methyl-3-oxidanyl-pyridin-4-yl]methyl]amino]ethanoic acid Openeye Name: 2-[carboxymethyl-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridyl]methyl]amino]acetic acid CAS Name: 2-[carboxymethyl-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methyl]amino]acetic acid IUPAC Name: 2-[carboxymethyl-[[3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-4-yl]methyl]amino]acetic acid Traditional Name: 2-[carboxymethyl-[(3-hydroxy-2-methyl-5-methylol-4-pyridyl)methyl]amino]acetic acid Formula: C12H16N2O6 MolecularWeight: 284.26524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=C1O)CN(CC(=O)O)CC(=O)O)CO

Isomeric SMILES

CC1=NC=C(C(=C1O)CN(CC(=O)O)CC(=O)O)CO

InChI

InChI=1S/C12H16N2O6/c1-7-12(20)9(8(6-15)2-13-7)3-14(4-10(16)17)5-11(18)19/h2,15,20H,3-6H2,1H3,(H,16,17)(H,18,19)