methyl 6-(4-cyanophenyl)-6-oxidanyl-hexanoate

Systemtic Name: methyl 6-(4-cyanophenyl)-6-oxidanyl-hexanoate Openeye Name: methyl 6-(4-cyanophenyl)-6-hydroxy-hexanoate CAS Name: 6-(4-cyanophenyl)-6-hydroxyhexanoic acid methyl ester IUPAC Name: methyl 6-(4-cyanophenyl)-6-hydroxyhexanoate Traditional Name: 6-(4-cyanophenyl)-6-hydroxy-hexanoic acid methyl ester Formula: C14H17NO3 MolecularWeight: 247.28968

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO3/c1-18-14(17)5-3-2-4-13(16)12-8-6-11(10-15)7-9-12/h6-9,13,16H,2-5H2,1H3