4,4-bis(3-methyl-4-oxidanyl-phenyl)pentanenitrile

Systemtic Name: 4,4-bis(3-methyl-4-oxidanyl-phenyl)pentanenitrile Openeye Name: 4,4-bis(4-hydroxy-3-methyl-phenyl)pentanenitrile CAS Name: 4,4-bis(4-hydroxy-3-methylphenyl)pentanenitrile IUPAC Name: 4,4-bis(4-hydroxy-3-methylphenyl)pentanenitrile Traditional Name: 4,4-bis(4-hydroxy-3-methyl-phenyl)valeronitrile Formula: C19H21NO2 MolecularWeight: 295.37554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(C)(CCC#N)C2=CC(=C(C=C2)O)C)O

Isomeric SMILES

CC1=C(C=CC(=C1)C(C)(CCC#N)C2=CC(=C(C=C2)O)C)O

InChI

InChI=1S/C19H21NO2/c1-13-11-15(5-7-17(13)21)19(3,9-4-10-20)16-6-8-18(22)14(2)12-16/h5-8,11-12,21-22H,4,9H2,1-3H3