2-cyclopropyl-2-[3-fluoranyl-2-[3-[methyl-(phenylmethyl)amino]propyl]phenyl]ethanenitrile

Systemtic Name: 2-cyclopropyl-2-[3-fluoranyl-2-[3-[methyl-(phenylmethyl)amino]propyl]phenyl]ethanenitrile Openeye Name: 2-[2-[3-[benzyl(methyl)amino]propyl]-3-fluoro-phenyl]-2-cyclopropyl-acetonitrile CAS Name: 2-cyclopropyl-2-[3-fluoro-2-[3-[methyl-(phenylmethyl)amino]propyl]phenyl]acetonitrile IUPAC Name: 2-[2-[3-[benzyl(methyl)amino]propyl]-3-fluorophenyl]-2-cyclopropylacetonitrile Traditional Name: 2-[2-[3-[benzyl(methyl)amino]propyl]-3-fluoro-phenyl]-2-cyclopropyl-acetonitrile Formula: C22H25FN2 MolecularWeight: 336.445703

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC1=C(C=CC=C1F)C(C#N)C2CC2)CC3=CC=CC=C3

Isomeric SMILES

CN(CCCC1=C(C=CC=C1F)C(C#N)C2CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H25FN2/c1-25(16-17-7-3-2-4-8-17)14-6-10-20-19(9-5-11-22(20)23)21(15-24)18-12-13-18/h2-5,7-9,11,18,21H,6,10,12-14,16H2,1H3