trimethyl 1-methyloctadec-9-yne-1,2,2-tricarboxylate

Systemtic Name: trimethyl 1-methyloctadec-9-yne-1,2,2-tricarboxylate Openeye Name: trimethyl 1-methyloctadec-9-yne-1,2,2-tricarboxylate CAS Name: 1-methyl-9-octadecyne-1,2,2-tricarboxylic acid trimethyl ester IUPAC Name: trimethyl 1-methyloctadec-9-yne-1,2,2-tricarboxylate Traditional Name: 1-methyloctadec-9-yne-1,2,2-tricarboxylic acid trimethyl ester Formula: C25H42O6 MolecularWeight: 438.59738

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC#CCCCCCCC(C(C)C(=O)OC)(C(=O)OC)C(=O)OC

Isomeric SMILES

CCCCCCCCC#CCCCCCCC(C(C)C(=O)OC)(C(=O)OC)C(=O)OC

InChI

InChI=1S/C25H42O6/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25(23(27)30-4,24(28)31-5)21(2)22(26)29-3/h21H,6-12,15-20H2,1-5H3