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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21FN2/c1-4-5-6-7-11(2)18-15-9-13(10-17)8-14(16)12(15)3/h8-9,11,18H,4-7H2,1-3H3