2-(isoquinolin-5-ylamino)benzenecarbonitrile

Systemtic Name: 2-(isoquinolin-5-ylamino)benzenecarbonitrile Openeye Name: 2-(5-isoquinolylamino)benzonitrile CAS Name: 2-(5-isoquinolinylamino)benzonitrile IUPAC Name: 2-(isoquinolin-5-ylamino)benzonitrile Traditional Name: 2-(5-isoquinolylamino)benzonitrile Formula: C16H11N3 MolecularWeight: 245.27864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)NC2=CC=CC3=C2C=CN=C3

Isomeric SMILES

C1=CC=C(C(=C1)C#N)NC2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C16H11N3/c17-10-12-4-1-2-6-15(12)19-16-7-3-5-13-11-18-9-8-14(13)16/h1-9,11,19H