2-oxidanylpropane-1,2,3-tricarboxylic acid; (9-phenylxanthen-9-yl) ethanoate

Systemtic Name: 2-oxidanylpropane-1,2,3-tricarboxylic acid; (9-phenylxanthen-9-yl) ethanoate Openeye Name: citric acid; (9-phenylxanthen-9-yl) acetate CAS Name: acetic acid (9-phenyl-9-xanthenyl) ester; 2-hydroxypropane-1,2,3-tricarboxylic acid IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylic acid; (9-phenylxanthen-9-yl) acetate Traditional Name: acetic acid (9-phenylxanthen-9-yl) ester; citric acid Formula: C27H24O10 MolecularWeight: 508.47346

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1(C2=CC=CC=C2OC3=CC=CC=C31)C4=CC=CC=C4.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

Isomeric SMILES

CC(=O)OC1(C2=CC=CC=C2OC3=CC=CC=C31)C4=CC=CC=C4.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C21H16O3.C6H8O7/c1-15(22)24-21(16-9-3-2-4-10-16)17-11-5-7-13-19(17)23-20-14-8-6-12-18(20)21;7-3(8)1-6(13,5(11)12)2-4(9)10/h2-14H,1H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)