4-(4-azanyl-3-bromanyl-5-tert-butyl-phenyl)benzenecarbonitrile

Systemtic Name: 4-(4-azanyl-3-bromanyl-5-tert-butyl-phenyl)benzenecarbonitrile Openeye Name: 4-(4-amino-3-bromo-5-tert-butyl-phenyl)benzonitrile CAS Name: 4-(4-amino-3-bromo-5-tert-butylphenyl)benzonitrile IUPAC Name: 4-(4-amino-3-bromo-5-tert-butylphenyl)benzonitrile Traditional Name: 4-(4-amino-3-bromo-5-tert-butyl-phenyl)benzonitrile Formula: C17H17BrN2 MolecularWeight: 329.23428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=CC(=C1)C2=CC=C(C=C2)C#N)Br)N

Isomeric SMILES

CC(C)(C)C1=C(C(=CC(=C1)C2=CC=C(C=C2)C#N)Br)N

InChI

InChI=1S/C17H17BrN2/c1-17(2,3)14-8-13(9-15(18)16(14)20)12-6-4-11(10-19)5-7-12/h4-9H,20H2,1-3H3