dimethyl 2-(2-prop-2-ynylpent-4-ynyl)propanedioate

Systemtic Name: dimethyl 2-(2-prop-2-ynylpent-4-ynyl)propanedioate Openeye Name: dimethyl 2-(2-prop-2-ynylpent-4-ynyl)propanedioate CAS Name: 2-(2-prop-2-ynylpent-4-ynyl)propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-(2-prop-2-ynylpent-4-ynyl)propanedioate Traditional Name: 2-(2-propargylpent-4-ynyl)malonic acid dimethyl ester Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16O4/c1-5-7-10(8-6-2)9-11(12(14)16-3)13(15)17-4/h1-2,10-11H,7-9H2,3-4H3