[4-(4-hydroxyphenyl)phenyl] 2-cyano-2-methyl-hexanoate

Systemtic Name: [4-(4-hydroxyphenyl)phenyl] 2-cyano-2-methyl-hexanoate Openeye Name: [4-(4-hydroxyphenyl)phenyl] 2-cyano-2-methyl-hexanoate CAS Name: 2-cyano-2-methylhexanoic acid [4-(4-hydroxyphenyl)phenyl] ester IUPAC Name: [4-(4-hydroxyphenyl)phenyl] 2-cyano-2-methylhexanoate Traditional Name: 2-cyano-2-methyl-hexanoic acid [4-(4-hydroxyphenyl)phenyl] ester Formula: C20H21NO3 MolecularWeight: 323.38564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(C#N)C(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)O

Isomeric SMILES

CCCCC(C)(C#N)C(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)O

InChI

InChI=1S/C20H21NO3/c1-3-4-13-20(2,14-21)19(23)24-18-11-7-16(8-12-18)15-5-9-17(22)10-6-15/h5-12,22H,3-4,13H2,1-2H3