4-[(2-bromanyl-6-tert-butyl-4-methoxy-phenoxy)methyl]benzenecarbonitrile

Systemtic Name: 4-[(2-bromanyl-6-tert-butyl-4-methoxy-phenoxy)methyl]benzenecarbonitrile Openeye Name: 4-[(2-bromo-6-tert-butyl-4-methoxy-phenoxy)methyl]benzonitrile CAS Name: 4-[(2-bromo-6-tert-butyl-4-methoxyphenoxy)methyl]benzonitrile IUPAC Name: 4-[(2-bromo-6-tert-butyl-4-methoxyphenoxy)methyl]benzonitrile Traditional Name: 4-[(2-bromo-6-tert-butyl-4-methoxy-phenoxy)methyl]benzonitrile Formula: C19H20BrNO2 MolecularWeight: 374.2716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1OCC2=CC=C(C=C2)C#N)Br)OC

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1OCC2=CC=C(C=C2)C#N)Br)OC

InChI

InChI=1S/C19H20BrNO2/c1-19(2,3)16-9-15(22-4)10-17(20)18(16)23-12-14-7-5-13(11-21)6-8-14/h5-10H,12H2,1-4H3