3-fluoranyl-4-[(4-methylpentan-2-ylamino)methyl]benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-[(4-methylpentan-2-ylamino)methyl]benzenecarbonitrile Openeye Name: 4-[(1,3-dimethylbutylamino)methyl]-3-fluoro-benzonitrile CAS Name: 3-fluoro-4-[(4-methylpentan-2-ylamino)methyl]benzonitrile IUPAC Name: 3-fluoro-4-[(4-methylpentan-2-ylamino)methyl]benzonitrile Traditional Name: 4-[(1,3-dimethylbutylamino)methyl]-3-fluoro-benzonitrile Formula: C14H19FN2 MolecularWeight: 234.312463

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C)NCC1=C(C=C(C=C1)C#N)F

Isomeric SMILES

CC(C)CC(C)NCC1=C(C=C(C=C1)C#N)F

InChI

InChI=1S/C14H19FN2/c1-10(2)6-11(3)17-9-13-5-4-12(8-16)7-14(13)15/h4-5,7,10-11,17H,6,9H2,1-3H3