3-fluoranyl-4-methyl-5-(5-methylheptan-3-ylamino)benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-methyl-5-(5-methylheptan-3-ylamino)benzenecarbonitrile Openeye Name: 3-[(1-ethyl-3-methyl-pentyl)amino]-5-fluoro-4-methyl-benzonitrile CAS Name: 3-fluoro-4-methyl-5-(5-methylheptan-3-ylamino)benzonitrile IUPAC Name: 3-fluoro-4-methyl-5-(5-methylheptan-3-ylamino)benzonitrile Traditional Name: 3-[(1-ethyl-3-methyl-pentyl)amino]-5-fluoro-4-methyl-benzonitrile Formula: C16H23FN2 MolecularWeight: 262.365623

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23FN2/c1-5-11(3)7-14(6-2)19-16-9-13(10-18)8-15(17)12(16)4/h8-9,11,14,19H,5-7H2,1-4H3