2-ethyl-6-methyl-pyridin-3-ol; 2-oxidanylpropane-1,2,3-tricarboxylic acid

Systemtic Name: 2-ethyl-6-methyl-pyridin-3-ol; 2-oxidanylpropane-1,2,3-tricarboxylic acid Openeye Name: citric acid; 2-ethyl-6-methyl-pyridin-3-ol CAS Name: 2-ethyl-6-methyl-3-pyridinol; 2-hydroxypropane-1,2,3-tricarboxylic acid IUPAC Name: 2-ethyl-6-methylpyridin-3-ol; 2-hydroxypropane-1,2,3-tricarboxylic acid Traditional Name: citric acid; 2-ethyl-6-methyl-pyridin-3-ol Formula: C14H19NO8 MolecularWeight: 329.30256

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=N1)C)O.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

Isomeric SMILES

CCC1=C(C=CC(=N1)C)O.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C8H11NO.C6H8O7/c1-3-7-8(10)5-4-6(2)9-7;7-3(8)1-6(13,5(11)12)2-4(9)10/h4-5,10H,3H2,1-2H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)