butanoic acid; tributyl 2-oxidanylpropane-1,2,3-tricarboxylate

Systemtic Name: butanoic acid; tributyl 2-oxidanylpropane-1,2,3-tricarboxylate Openeye Name: butyric acid; tributyl 2-hydroxypropane-1,2,3-tricarboxylate CAS Name: butanoic acid; 2-hydroxypropane-1,2,3-tricarboxylic acid tributyl ester IUPAC Name: butanoic acid; tributyl 2-hydroxypropane-1,2,3-tricarboxylate Traditional Name: butyric acid; 2-hydroxypropane-1,2,3-tricarboxylic acid tributyl ester Formula: C22H40O9 MolecularWeight: 448.5476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CC(CC(=O)OCCCC)(C(=O)OCCCC)O.CCCC(=O)O

Isomeric SMILES

CCCCOC(=O)CC(CC(=O)OCCCC)(C(=O)OCCCC)O.CCCC(=O)O

InChI

InChI=1S/C18H32O7.C4H8O2/c1-4-7-10-23-15(19)13-18(22,17(21)25-12-9-6-3)14-16(20)24-11-8-5-2;1-2-3-4(5)6/h22H,4-14H2,1-3H3;2-3H2,1H3,(H,5,6)