2-(2-chloroethyl)-1H-isoquinoline-4-carbonitrile

Systemtic Name: 2-(2-chloroethyl)-1H-isoquinoline-4-carbonitrile Openeye Name: 2-(2-chloroethyl)-1H-isoquinoline-4-carbonitrile CAS Name: 2-(2-chloroethyl)-1H-isoquinoline-4-carbonitrile IUPAC Name: 2-(2-chloroethyl)-1H-isoquinoline-4-carbonitrile Traditional Name: 2-(2-chloroethyl)-1H-isoquinoline-4-carbonitrile Formula: C12H11ClN2 MolecularWeight: 218.68214

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=CN1CCCl)C#N

Isomeric SMILES

C1C2=CC=CC=C2C(=CN1CCCl)C#N

InChI

InChI=1S/C12H11ClN2/c13-5-6-15-8-10-3-1-2-4-12(10)11(7-14)9-15/h1-4,9H,5-6,8H2