2-(5-bromanyl-2-methoxy-phenyl)-2-(propylamino)ethanenitrile

Systemtic Name: 2-(5-bromanyl-2-methoxy-phenyl)-2-(propylamino)ethanenitrile Openeye Name: 2-(5-bromo-2-methoxy-phenyl)-2-(propylamino)acetonitrile CAS Name: 2-(5-bromo-2-methoxyphenyl)-2-(propylamino)acetonitrile IUPAC Name: 2-(5-bromo-2-methoxyphenyl)-2-(propylamino)acetonitrile Traditional Name: 2-(5-bromo-2-methoxy-phenyl)-2-(propylamino)acetonitrile Formula: C12H15BrN2O MolecularWeight: 283.1643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(C#N)C1=C(C=CC(=C1)Br)OC

Isomeric SMILES

CCCNC(C#N)C1=C(C=CC(=C1)Br)OC

InChI

InChI=1S/C12H15BrN2O/c1-3-6-15-11(8-14)10-7-9(13)4-5-12(10)16-2/h4-5,7,11,15H,3,6H2,1-2H3