dimethyl 2-[(E)-5,5-dicyanooct-2-en-7-ynyl]-2-prop-2-enyl-propanedioate

Systemtic Name: dimethyl 2-[(E)-5,5-dicyanooct-2-en-7-ynyl]-2-prop-2-enyl-propanedioate Openeye Name: dimethyl 2-allyl-2-[(E)-5,5-dicyanooct-2-en-7-ynyl]propanedioate CAS Name: 2-[(E)-5,5-dicyanooct-2-en-7-ynyl]-2-prop-2-enylpropanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(E)-5,5-dicyanooct-2-en-7-ynyl]-2-prop-2-enylpropanedioate Traditional Name: 2-allyl-2-[(E)-5,5-dicyanooct-2-en-7-ynyl]malonic acid dimethyl ester Formula: C18H20N2O4 MolecularWeight: 328.3624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O4/c1-5-9-17(13-19,14-20)11-7-8-12-18(10-6-2,15(21)23-3)16(22)24-4/h1,6-8H,2,9-12H2,3-4H3/b8-7+