3-fluoranyl-4-methyl-5-[(3,3,5-trimethylcyclohexyl)amino]benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-methyl-5-[(3,3,5-trimethylcyclohexyl)amino]benzenecarbonitrile Openeye Name: 3-fluoro-4-methyl-5-[(3,3,5-trimethylcyclohexyl)amino]benzonitrile CAS Name: 3-fluoro-4-methyl-5-[(3,3,5-trimethylcyclohexyl)amino]benzonitrile IUPAC Name: 3-fluoro-4-methyl-5-[(3,3,5-trimethylcyclohexyl)amino]benzonitrile Traditional Name: 3-fluoro-4-methyl-5-[(3,3,5-trimethylcyclohexyl)amino]benzonitrile Formula: C17H23FN2 MolecularWeight: 274.376323

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(C1)(C)C)NC2=C(C(=CC(=C2)C#N)F)C

Isomeric SMILES

CC1CC(CC(C1)(C)C)NC2=C(C(=CC(=C2)C#N)F)C

InChI

InChI=1S/C17H23FN2/c1-11-5-14(9-17(3,4)8-11)20-16-7-13(10-19)6-15(18)12(16)2/h6-7,11,14,20H,5,8-9H2,1-4H3