diethyl 2-cyano-2-phenyl-hexanedioate

Systemtic Name: diethyl 2-cyano-2-phenyl-hexanedioate Openeye Name: diethyl 2-cyano-2-phenyl-hexanedioate CAS Name: 2-cyano-2-phenylhexanedioic acid diethyl ester IUPAC Name: diethyl 2-cyano-2-phenylhexanedioate Traditional Name: 2-cyano-2-phenyl-adipic acid diethyl ester Formula: C17H21NO4 MolecularWeight: 303.35294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21NO4/c1-3-21-15(19)11-8-12-17(13-18,16(20)22-4-2)14-9-6-5-7-10-14/h5-7,9-10H,3-4,8,11-12H2,1-2H3