(10-methyl-9-phenyl-acridin-9-yl) propanoate; 2-oxidanylpropane-1,2,3-tricarboxylic acid

Systemtic Name: (10-methyl-9-phenyl-acridin-9-yl) propanoate; 2-oxidanylpropane-1,2,3-tricarboxylic acid Openeye Name: citric acid; (10-methyl-9-phenyl-acridin-9-yl) propanoate CAS Name: 2-hydroxypropane-1,2,3-tricarboxylic acid; propanoic acid (10-methyl-9-phenyl-9-acridinyl) ester IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylic acid; (10-methyl-9-phenylacridin-9-yl) propanoate Traditional Name: citric acid; propionic acid (10-methyl-9-phenyl-acridin-9-yl) ester Formula: C29H29NO9 MolecularWeight: 535.54186

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1(C2=CC=CC=C2N(C3=CC=CC=C31)C)C4=CC=CC=C4.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

Isomeric SMILES

CCC(=O)OC1(C2=CC=CC=C2N(C3=CC=CC=C31)C)C4=CC=CC=C4.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C23H21NO2.C6H8O7/c1-3-22(25)26-23(17-11-5-4-6-12-17)18-13-7-9-15-20(18)24(2)21-16-10-8-14-19(21)23;7-3(8)1-6(13,5(11)12)2-4(9)10/h4-16H,3H2,1-2H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)