diethyl 2-(2-cyanoethyl)-2-phenyl-propanedioate

Systemtic Name: diethyl 2-(2-cyanoethyl)-2-phenyl-propanedioate Openeye Name: diethyl 2-(2-cyanoethyl)-2-phenyl-propanedioate CAS Name: 2-(2-cyanoethyl)-2-phenylpropanedioic acid diethyl ester IUPAC Name: diethyl 2-(2-cyanoethyl)-2-phenylpropanedioate Traditional Name: 2-(2-cyanoethyl)-2-phenyl-malonic acid diethyl ester Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC#N)(C1=CC=CC=C1)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CCC#N)(C1=CC=CC=C1)C(=O)OCC

InChI

InChI=1S/C16H19NO4/c1-3-20-14(18)16(11-8-12-17,15(19)21-4-2)13-9-6-5-7-10-13/h5-7,9-10H,3-4,8,11H2,1-2H3