2-oxidanylpropane-1,2,3-tricarboxylic acid; 1H-quinolin-2-one

Systemtic Name: 2-oxidanylpropane-1,2,3-tricarboxylic acid; 1H-quinolin-2-one Openeye Name: citric acid; 1H-quinolin-2-one CAS Name: 2-hydroxypropane-1,2,3-tricarboxylic acid; 1H-quinolin-2-one IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylic acid; 1H-quinolin-2-one Traditional Name: carbostyril; citric acid Formula: C21H23NO15 MolecularWeight: 529.40502

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=O)N2.C(C(=O)O)C(CC(=O)O)(C(=O)O)O.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=O)N2.C(C(=O)O)C(CC(=O)O)(C(=O)O)O.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C9H7NO.2C6H8O7/c11-9-6-5-7-3-1-2-4-8(7)10-9;2*7-3(8)1-6(13,5(11)12)2-4(9)10/h1-6H,(H,10,11);2*13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)