4-[1-(isoquinolin-5-ylamino)ethyl]benzenecarbonitrile

Systemtic Name: 4-[1-(isoquinolin-5-ylamino)ethyl]benzenecarbonitrile Openeye Name: 4-[1-(5-isoquinolylamino)ethyl]benzonitrile CAS Name: 4-[1-(5-isoquinolinylamino)ethyl]benzonitrile IUPAC Name: 4-[1-(isoquinolin-5-ylamino)ethyl]benzonitrile Traditional Name: 4-[1-(5-isoquinolylamino)ethyl]benzonitrile Formula: C18H15N3 MolecularWeight: 273.3318

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15N3/c1-13(15-7-5-14(11-19)6-8-15)21-18-4-2-3-16-12-20-10-9-17(16)18/h2-10,12-13,21H,1H3