3-fluoranyl-4-[propan-2-yl(propyl)amino]benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-[propan-2-yl(propyl)amino]benzenecarbonitrile Openeye Name: 3-fluoro-4-[isopropyl(propyl)amino]benzonitrile CAS Name: 3-fluoro-4-[propan-2-yl(propyl)amino]benzonitrile IUPAC Name: 3-fluoro-4-[propan-2-yl(propyl)amino]benzonitrile Traditional Name: 3-fluoro-4-[isopropyl(propyl)amino]benzonitrile Formula: C13H17FN2 MolecularWeight: 220.285883

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=C(C=C(C=C1)C#N)F)C(C)C

Isomeric SMILES

CCCN(C1=C(C=C(C=C1)C#N)F)C(C)C

InChI

InChI=1S/C13H17FN2/c1-4-7-16(10(2)3)13-6-5-11(9-15)8-12(13)14/h5-6,8,10H,4,7H2,1-3H3