3-[(2,6-dimethylcyclohexyl)amino]-5-fluoranyl-4-methyl-benzenecarbonitrile

Systemtic Name: 3-[(2,6-dimethylcyclohexyl)amino]-5-fluoranyl-4-methyl-benzenecarbonitrile Openeye Name: 3-[(2,6-dimethylcyclohexyl)amino]-5-fluoro-4-methyl-benzonitrile CAS Name: 3-[(2,6-dimethylcyclohexyl)amino]-5-fluoro-4-methylbenzonitrile IUPAC Name: 3-[(2,6-dimethylcyclohexyl)amino]-5-fluoro-4-methylbenzonitrile Traditional Name: 3-[(2,6-dimethylcyclohexyl)amino]-5-fluoro-4-methyl-benzonitrile Formula: C16H21FN2 MolecularWeight: 260.349743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1NC2=C(C(=CC(=C2)C#N)F)C)C

Isomeric SMILES

CC1CCCC(C1NC2=C(C(=CC(=C2)C#N)F)C)C

InChI

InChI=1S/C16H21FN2/c1-10-5-4-6-11(2)16(10)19-15-8-13(9-18)7-14(17)12(15)3/h7-8,10-11,16,19H,4-6H2,1-3H3