4-[4-(3-methylphenoxy)phenyl]-4-oxidanyl-pentanenitrile

Systemtic Name: 4-[4-(3-methylphenoxy)phenyl]-4-oxidanyl-pentanenitrile Openeye Name: 4-hydroxy-4-[4-(3-methylphenoxy)phenyl]pentanenitrile CAS Name: 4-hydroxy-4-[4-(3-methylphenoxy)phenyl]pentanenitrile IUPAC Name: 4-hydroxy-4-[4-(3-methylphenoxy)phenyl]pentanenitrile Traditional Name: 4-hydroxy-4-[4-(3-methylphenoxy)phenyl]valeronitrile Formula: C18H19NO2 MolecularWeight: 281.34896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=CC=C(C=C2)C(C)(CCC#N)O

Isomeric SMILES

CC1=CC(=CC=C1)OC2=CC=C(C=C2)C(C)(CCC#N)O

InChI

InChI=1S/C18H19NO2/c1-14-5-3-6-17(13-14)21-16-9-7-15(8-10-16)18(2,20)11-4-12-19/h3,5-10,13,20H,4,11H2,1-2H3