5-azanyl-2-[2-(2,2-dimethylpropoxy)phenyl]benzenecarbonitrile

Systemtic Name: 5-azanyl-2-[2-(2,2-dimethylpropoxy)phenyl]benzenecarbonitrile Openeye Name: 5-amino-2-[2-(2,2-dimethylpropoxy)phenyl]benzonitrile CAS Name: 5-amino-2-[2-(2,2-dimethylpropoxy)phenyl]benzonitrile IUPAC Name: 5-amino-2-[2-(2,2-dimethylpropoxy)phenyl]benzonitrile Traditional Name: 5-amino-2-(2-neopentyloxyphenyl)benzonitrile Formula: C18H20N2O MolecularWeight: 280.3642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)COC1=CC=CC=C1C2=C(C=C(C=C2)N)C#N

Isomeric SMILES

CC(C)(C)COC1=CC=CC=C1C2=C(C=C(C=C2)N)C#N

InChI

InChI=1S/C18H20N2O/c1-18(2,3)12-21-17-7-5-4-6-16(17)15-9-8-14(20)10-13(15)11-19/h4-10H,12,20H2,1-3H3