sodium 2-[bis(2-hydroxyethyl)amino]-2-pyridin-3-yl-propanoate

Systemtic Name: sodium 2-[bis(2-hydroxyethyl)amino]-2-pyridin-3-yl-propanoate Openeye Name: sodium 2-[bis(2-hydroxyethyl)amino]-2-(3-pyridyl)propanoate CAS Name: sodium 2-[bis(2-hydroxyethyl)amino]-2-(3-pyridinyl)propanoate IUPAC Name: sodium 2-[bis(2-hydroxyethyl)amino]-2-pyridin-3-ylpropanoate Traditional Name: sodium 2-[bis(2-hydroxyethyl)amino]-2-(3-pyridyl)propionate Formula: C12H17N2NaO4 MolecularWeight: 276.26415

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CN=CC=C1)(C(=O)[O-])N(CCO)CCO.[Na+]

Isomeric SMILES

CC(C1=CN=CC=C1)(C(=O)[O-])N(CCO)CCO.[Na+]

InChI

InChI=1S/C12H18N2O4.Na/c1-12(11(17)18,10-3-2-4-13-9-10)14(5-7-15)6-8-16;/h2-4,9,15-16H,5-8H2,1H3,(H,17,18);/q;+1/p-1