diethyl 2-octyl-2-prop-2-ynyl-propanedioate

Systemtic Name: diethyl 2-octyl-2-prop-2-ynyl-propanedioate Openeye Name: diethyl 2-octyl-2-prop-2-ynyl-propanedioate CAS Name: 2-octyl-2-prop-2-ynylpropanedioic acid diethyl ester IUPAC Name: diethyl 2-octyl-2-prop-2-ynylpropanedioate Traditional Name: 2-octyl-2-propargyl-malonic acid diethyl ester Formula: C18H30O4 MolecularWeight: 310.4284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CC#C)(C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCCCCCCCC(CC#C)(C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C18H30O4/c1-5-9-10-11-12-13-15-18(14-6-2,16(19)21-7-3)17(20)22-8-4/h2H,5,7-15H2,1,3-4H3