2-[4-[(3,5-dimethyl-4-oxidanyl-phenyl)methylamino]phenyl]ethanenitrile

Systemtic Name: 2-[4-[(3,5-dimethyl-4-oxidanyl-phenyl)methylamino]phenyl]ethanenitrile Openeye Name: 2-[4-[(4-hydroxy-3,5-dimethyl-phenyl)methylamino]phenyl]acetonitrile CAS Name: 2-[4-[(4-hydroxy-3,5-dimethylphenyl)methylamino]phenyl]acetonitrile IUPAC Name: 2-[4-[(4-hydroxy-3,5-dimethylphenyl)methylamino]phenyl]acetonitrile Traditional Name: 2-[4-[(4-hydroxy-3,5-dimethyl-benzyl)amino]phenyl]acetonitrile Formula: C17H18N2O MolecularWeight: 266.33762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)CNC2=CC=C(C=C2)CC#N

Isomeric SMILES

CC1=CC(=CC(=C1O)C)CNC2=CC=C(C=C2)CC#N

InChI

InChI=1S/C17H18N2O/c1-12-9-15(10-13(2)17(12)20)11-19-16-5-3-14(4-6-16)7-8-18/h3-6,9-10,19-20H,7,11H2,1-2H3