3-[(5-bromanyl-2-methyl-phenyl)amino]pentanenitrile

Systemtic Name: 3-[(5-bromanyl-2-methyl-phenyl)amino]pentanenitrile Openeye Name: 3-(5-bromo-2-methyl-anilino)pentanenitrile CAS Name: 3-(5-bromo-2-methylanilino)pentanenitrile IUPAC Name: 3-(5-bromo-2-methylanilino)pentanenitrile Traditional Name: 3-(5-bromo-2-methyl-anilino)valeronitrile Formula: C12H15BrN2 MolecularWeight: 267.1649

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC#N)NC1=C(C=CC(=C1)Br)C

Isomeric SMILES

CCC(CC#N)NC1=C(C=CC(=C1)Br)C

InChI

InChI=1S/C12H15BrN2/c1-3-11(6-7-14)15-12-8-10(13)5-4-9(12)2/h4-5,8,11,15H,3,6H2,1-2H3