4-[(E)-2-(6-phenylmethoxy-3,4-dihydroisoquinolin-1-yl)ethenyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-2-(6-phenylmethoxy-3,4-dihydroisoquinolin-1-yl)ethenyl]benzenecarbonitrile Openeye Name: 4-[(E)-2-(6-benzyloxy-3,4-dihydroisoquinolin-1-yl)vinyl]benzonitrile CAS Name: 4-[(E)-2-(6-phenylmethoxy-3,4-dihydroisoquinolin-1-yl)ethenyl]benzonitrile IUPAC Name: 4-[(E)-2-(6-phenylmethoxy-3,4-dihydroisoquinolin-1-yl)ethenyl]benzonitrile Traditional Name: 4-[(E)-2-(6-benzoxy-3,4-dihydroisoquinolin-1-yl)vinyl]benzonitrile Formula: C25H20N2O MolecularWeight: 364.4391

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(C2=C1C=C(C=C2)OCC3=CC=CC=C3)C=CC4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN=C(C2=C1C=C(C=C2)OCC3=CC=CC=C3)/C=C/C4=CC=C(C=C4)C#N

InChI

InChI=1S/C25H20N2O/c26-17-20-8-6-19(7-9-20)10-13-25-24-12-11-23(16-22(24)14-15-27-25)28-18-21-4-2-1-3-5-21/h1-13,16H,14-15,18H2/b13-10+