2-[1-(3-chlorophenyl)-1,3-dihydroisoindol-2-yl]ethanenitrile

Systemtic Name: 2-[1-(3-chlorophenyl)-1,3-dihydroisoindol-2-yl]ethanenitrile Openeye Name: 2-[1-(3-chlorophenyl)isoindolin-2-yl]acetonitrile CAS Name: 2-[1-(3-chlorophenyl)-1,3-dihydroisoindol-2-yl]acetonitrile IUPAC Name: 2-[1-(3-chlorophenyl)-1,3-dihydroisoindol-2-yl]acetonitrile Traditional Name: 2-[1-(3-chlorophenyl)isoindolin-2-yl]acetonitrile Formula: C16H13ClN2 MolecularWeight: 268.74082

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(N1CC#N)C3=CC(=CC=C3)Cl

Isomeric SMILES

C1C2=CC=CC=C2C(N1CC#N)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C16H13ClN2/c17-14-6-3-5-12(10-14)16-15-7-2-1-4-13(15)11-19(16)9-8-18/h1-7,10,16H,9,11H2