3-fluoranyl-4-methyl-5-(5-methylhexan-2-ylamino)benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-methyl-5-(5-methylhexan-2-ylamino)benzenecarbonitrile Openeye Name: 3-(1,4-dimethylpentylamino)-5-fluoro-4-methyl-benzonitrile CAS Name: 3-fluoro-4-methyl-5-(5-methylhexan-2-ylamino)benzonitrile IUPAC Name: 3-fluoro-4-methyl-5-(5-methylhexan-2-ylamino)benzonitrile Traditional Name: 3-(1,4-dimethylpentylamino)-5-fluoro-4-methyl-benzonitrile Formula: C15H21FN2 MolecularWeight: 248.339043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1F)C#N)NC(C)CCC(C)C

Isomeric SMILES

CC1=C(C=C(C=C1F)C#N)NC(C)CCC(C)C

InChI

InChI=1S/C15H21FN2/c1-10(2)5-6-11(3)18-15-8-13(9-17)7-14(16)12(15)4/h7-8,10-11,18H,5-6H2,1-4H3