methyl 4-cyano-6-oxidanylidene-4-phenyl-hexanoate

Systemtic Name: methyl 4-cyano-6-oxidanylidene-4-phenyl-hexanoate Openeye Name: methyl 4-cyano-6-oxo-4-phenyl-hexanoate CAS Name: 4-cyano-6-oxo-4-phenylhexanoic acid methyl ester IUPAC Name: methyl 4-cyano-6-oxo-4-phenylhexanoate Traditional Name: 4-cyano-6-keto-4-phenyl-hexanoic acid methyl ester Formula: C14H15NO3 MolecularWeight: 245.2738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15NO3/c1-18-13(17)7-8-14(11-15,9-10-16)12-5-3-2-4-6-12/h2-6,10H,7-9H2,1H3