tris(but-3-ynyl) benzene-1,2,4-tricarboxylate

Systemtic Name: tris(but-3-ynyl) benzene-1,2,4-tricarboxylate Openeye Name: tris(but-3-ynyl) benzene-1,2,4-tricarboxylate CAS Name: benzene-1,2,4-tricarboxylic acid tris(but-3-ynyl) ester IUPAC Name: tris(but-3-ynyl) benzene-1,2,4-tricarboxylate Traditional Name: benzene-1,2,4-tricarboxylic acid tris(but-3-ynyl) ester Formula: C21H18O6 MolecularWeight: 366.36402

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Descriptors Computed from Structure

Canonical SMILES:

C#CCCOC(=O)C1=CC(=C(C=C1)C(=O)OCCC#C)C(=O)OCCC#C

Isomeric SMILES

C#CCCOC(=O)C1=CC(=C(C=C1)C(=O)OCCC#C)C(=O)OCCC#C

InChI

InChI=1S/C21H18O6/c1-4-7-12-25-19(22)16-10-11-17(20(23)26-13-8-5-2)18(15-16)21(24)27-14-9-6-3/h1-3,10-11,15H,7-9,12-14H2