(E)-3-[4-(cyanomethoxy)phenyl]-N-(5-piperidin-1-ylisoquinolin-8-yl)prop-2-enamide

Systemtic Name: (E)-3-[4-(cyanomethoxy)phenyl]-N-(5-piperidin-1-ylisoquinolin-8-yl)prop-2-enamide Openeye Name: (E)-3-[4-(cyanomethoxy)phenyl]-N-[5-(1-piperidyl)-8-isoquinolyl]prop-2-enamide CAS Name: (E)-3-[4-(cyanomethoxy)phenyl]-N-[5-(1-piperidinyl)-8-isoquinolinyl]-2-propenamide IUPAC Name: (E)-3-[4-(cyanomethoxy)phenyl]-N-(5-piperidin-1-ylisoquinolin-8-yl)prop-2-enamide Traditional Name: (E)-3-[4-(cyanomethoxy)phenyl]-N-(5-piperidino-8-isoquinolyl)acrylamide Formula: C25H24N4O2 MolecularWeight: 412.48366

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C3C=CN=CC3=C(C=C2)NC(=O)C=CC4=CC=C(C=C4)OCC#N

Isomeric SMILES

C1CCN(CC1)C2=C3C=CN=CC3=C(C=C2)NC(=O)/C=C/C4=CC=C(C=C4)OCC#N

InChI

InChI=1S/C25H24N4O2/c26-13-17-31-20-7-4-19(5-8-20)6-11-25(30)28-23-9-10-24(29-15-2-1-3-16-29)21-12-14-27-18-22(21)23/h4-12,14,18H,1-3,15-17H2,(H,28,30)/b11-6+