3-[(5-tert-butyl-2-oxidanyl-3-phenyl-phenyl)methyl-methyl-amino]propanenitrile

Systemtic Name: 3-[(5-tert-butyl-2-oxidanyl-3-phenyl-phenyl)methyl-methyl-amino]propanenitrile Openeye Name: 3-[(5-tert-butyl-2-hydroxy-3-phenyl-phenyl)methyl-methyl-amino]propanenitrile CAS Name: 3-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methyl-methylamino]propanenitrile IUPAC Name: 3-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methyl-methylamino]propanenitrile Traditional Name: 3-[(5-tert-butyl-2-hydroxy-3-phenyl-benzyl)-methyl-amino]propionitrile Formula: C21H26N2O MolecularWeight: 322.44394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O/c1-21(2,3)18-13-17(15-23(4)12-8-11-22)20(24)19(14-18)16-9-6-5-7-10-16/h5-7,9-10,13-14,24H,8,12,15H2,1-4H3