trimethyl hepta-1,6-diyne-1,4,4-tricarboxylate

Systemtic Name: trimethyl hepta-1,6-diyne-1,4,4-tricarboxylate Openeye Name: trimethyl hepta-1,6-diyne-1,4,4-tricarboxylate CAS Name: hepta-1,6-diyne-1,4,4-tricarboxylic acid trimethyl ester IUPAC Name: trimethyl hepta-1,6-diyne-1,4,4-tricarboxylate Traditional Name: hepta-1,6-diyne-1,4,4-tricarboxylic acid trimethyl ester Formula: C13H14O6 MolecularWeight: 266.24666

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C#CCC(CC#C)(C(=O)OC)C(=O)OC

Isomeric SMILES

COC(=O)C#CCC(CC#C)(C(=O)OC)C(=O)OC

InChI

InChI=1S/C13H14O6/c1-5-8-13(11(15)18-3,12(16)19-4)9-6-7-10(14)17-2/h1H,8-9H2,2-4H3