3-[8-[[1-(2-hydroxyethyl)piperidin-4-yl]amino]isoquinolin-6-yl]benzenecarbonitrile

Systemtic Name: 3-[8-[[1-(2-hydroxyethyl)piperidin-4-yl]amino]isoquinolin-6-yl]benzenecarbonitrile Openeye Name: 3-[8-[[1-(2-hydroxyethyl)-4-piperidyl]amino]-6-isoquinolyl]benzonitrile CAS Name: 3-[8-[[1-(2-hydroxyethyl)-4-piperidinyl]amino]-6-isoquinolinyl]benzonitrile IUPAC Name: 3-[8-[[1-(2-hydroxyethyl)piperidin-4-yl]amino]isoquinolin-6-yl]benzonitrile Traditional Name: 3-[8-[[1-(2-hydroxyethyl)-4-piperidyl]amino]-6-isoquinolyl]benzonitrile Formula: C23H24N4O MolecularWeight: 372.46286

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC2=C3C=NC=CC3=CC(=C2)C4=CC=CC(=C4)C#N)CCO

Isomeric SMILES

C1CN(CCC1NC2=C3C=NC=CC3=CC(=C2)C4=CC=CC(=C4)C#N)CCO

InChI

InChI=1S/C23H24N4O/c24-15-17-2-1-3-18(12-17)20-13-19-4-7-25-16-22(19)23(14-20)26-21-5-8-27(9-6-21)10-11-28/h1-4,7,12-14,16,21,26,28H,5-6,8-11H2