2-[4-[1-[(2-bromanyl-4-methyl-phenyl)amino]ethyl]phenoxy]ethanenitrile

Systemtic Name: 2-[4-[1-[(2-bromanyl-4-methyl-phenyl)amino]ethyl]phenoxy]ethanenitrile Openeye Name: 2-[4-[1-(2-bromo-4-methyl-anilino)ethyl]phenoxy]acetonitrile CAS Name: 2-[4-[1-(2-bromo-4-methylanilino)ethyl]phenoxy]acetonitrile IUPAC Name: 2-[4-[1-(2-bromo-4-methylanilino)ethyl]phenoxy]acetonitrile Traditional Name: 2-[4-[1-(2-bromo-4-methyl-anilino)ethyl]phenoxy]acetonitrile Formula: C17H17BrN2O MolecularWeight: 345.23368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(C)C2=CC=C(C=C2)OCC#N)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(C)C2=CC=C(C=C2)OCC#N)Br

InChI

InChI=1S/C17H17BrN2O/c1-12-3-8-17(16(18)11-12)20-13(2)14-4-6-15(7-5-14)21-10-9-19/h3-8,11,13,20H,10H2,1-2H3