dimethyl 4-cyano-4-phenyl-heptanedioate

Systemtic Name: dimethyl 4-cyano-4-phenyl-heptanedioate Openeye Name: dimethyl 4-cyano-4-phenyl-heptanedioate CAS Name: 4-cyano-4-phenylheptanedioic acid dimethyl ester IUPAC Name: dimethyl 4-cyano-4-phenylheptanedioate Traditional Name: 4-cyano-4-phenyl-pimelic acid dimethyl ester Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(CCC(=O)OC)(C#N)C1=CC=CC=C1

Isomeric SMILES

COC(=O)CCC(CCC(=O)OC)(C#N)C1=CC=CC=C1

InChI

InChI=1S/C16H19NO4/c1-20-14(18)8-10-16(12-17,11-9-15(19)21-2)13-6-4-3-5-7-13/h3-7H,8-11H2,1-2H3