ethyl 2-cyano-5-(4-hydroxyphenyl)-5-methyl-hexanoate

Systemtic Name: ethyl 2-cyano-5-(4-hydroxyphenyl)-5-methyl-hexanoate Openeye Name: ethyl 2-cyano-5-(4-hydroxyphenyl)-5-methyl-hexanoate CAS Name: 2-cyano-5-(4-hydroxyphenyl)-5-methylhexanoic acid ethyl ester IUPAC Name: ethyl 2-cyano-5-(4-hydroxyphenyl)-5-methylhexanoate Traditional Name: 2-cyano-5-(4-hydroxyphenyl)-5-methyl-hexanoic acid ethyl ester Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO3/c1-4-20-15(19)12(11-17)9-10-16(2,3)13-5-7-14(18)8-6-13/h5-8,12,18H,4,9-10H2,1-3H3