dimethyl 2-but-2-ynyl-2-(cyanomethyl)propanedioate

Systemtic Name: dimethyl 2-but-2-ynyl-2-(cyanomethyl)propanedioate Openeye Name: dimethyl 2-but-2-ynyl-2-(cyanomethyl)propanedioate CAS Name: 2-but-2-ynyl-2-(cyanomethyl)propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-but-2-ynyl-2-(cyanomethyl)propanedioate Traditional Name: 2-but-2-ynyl-2-(cyanomethyl)malonic acid dimethyl ester Formula: C11H13NO4 MolecularWeight: 223.22522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13NO4/c1-4-5-6-11(7-8-12,9(13)15-2)10(14)16-3/h6-7H2,1-3H3