2-methylquinolin-4-amine; 2-oxidanylpropane-1,2,3-tricarboxylic acid

Systemtic Name: 2-methylquinolin-4-amine; 2-oxidanylpropane-1,2,3-tricarboxylic acid Openeye Name: citric acid; 2-methylquinolin-4-amine CAS Name: 2-hydroxypropane-1,2,3-tricarboxylic acid; 2-methyl-4-quinolinamine IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylic acid; 2-methylquinolin-4-amine Traditional Name: citric acid; (2-methyl-4-quinolyl)amine Formula: C16H18N2O7 MolecularWeight: 350.32332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)N.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)N.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C10H10N2.C6H8O7/c1-7-6-9(11)8-4-2-3-5-10(8)12-7;7-3(8)1-6(13,5(11)12)2-4(9)10/h2-6H,1H3,(H2,11,12);13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)