diethyl 2-[3-(2-methanoylcyclohexen-1-yl)prop-2-ynyl]-2-prop-2-ynyl-propanedioate

Systemtic Name: diethyl 2-[3-(2-methanoylcyclohexen-1-yl)prop-2-ynyl]-2-prop-2-ynyl-propanedioate Openeye Name: diethyl 2-[3-(2-formylcyclohexen-1-yl)prop-2-ynyl]-2-prop-2-ynyl-propanedioate CAS Name: 2-[3-(2-formyl-1-cyclohexenyl)prop-2-ynyl]-2-prop-2-ynylpropanedioic acid diethyl ester IUPAC Name: diethyl 2-[3-(2-formylcyclohexen-1-yl)prop-2-ynyl]-2-prop-2-ynylpropanedioate Traditional Name: 2-[3-(2-formylcyclohexen-1-yl)prop-2-ynyl]-2-propargyl-malonic acid diethyl ester Formula: C20H24O5 MolecularWeight: 344.40156

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC#C)(CC#CC1=C(CCCC1)C=O)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CC#C)(CC#CC1=C(CCCC1)C=O)C(=O)OCC

InChI

InChI=1S/C20H24O5/c1-4-13-20(18(22)24-5-2,19(23)25-6-3)14-9-12-16-10-7-8-11-17(16)15-21/h1,15H,5-8,10-11,13-14H2,2-3H3