5-[[4-[2-[methyl(pyridin-2-yl)amino]ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione; 2-oxidanylpropane-1,2,3-tricarboxylic acid

Systemtic Name: 5-[[4-[2-[methyl(pyridin-2-yl)amino]ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione; 2-oxidanylpropane-1,2,3-tricarboxylic acid Openeye Name: citric acid; 5-[[4-[2-[methyl(2-pyridyl)amino]ethoxy]phenyl]methyl]thiazolidine-2,4-dione CAS Name: 2-hydroxypropane-1,2,3-tricarboxylic acid; 5-[[4-[2-[methyl(2-pyridinyl)amino]ethoxy]phenyl]methyl]thiazolidine-2,4-dione IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylic acid; 5-[[4-[2-[methyl(pyridin-2-yl)amino]ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione Traditional Name: citric acid; 5-[4-[2-[methyl(2-pyridyl)amino]ethoxy]benzyl]thiazolidine-2,4-quinone Formula: C24H27N3O10S MolecularWeight: 549.55028

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=CC=C(C=C1)CC2C(=O)NC(=O)S2)C3=CC=CC=N3.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

Isomeric SMILES

CN(CCOC1=CC=C(C=C1)CC2C(=O)NC(=O)S2)C3=CC=CC=N3.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C18H19N3O3S.C6H8O7/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15;7-3(8)1-6(13,5(11)12)2-4(9)10/h2-9,15H,10-12H2,1H3,(H,20,22,23);13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)