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

Systemtic Name: 4-[(E)-2-(6-hexoxy-3,4-dihydroisoquinolin-1-yl)ethenyl]benzenecarbonitrile Openeye Name: 4-[(E)-2-(6-hexoxy-3,4-dihydroisoquinolin-1-yl)vinyl]benzonitrile CAS Name: 4-[(E)-2-(6-hexoxy-3,4-dihydroisoquinolin-1-yl)ethenyl]benzonitrile IUPAC Name: 4-[(E)-2-(6-hexoxy-3,4-dihydroisoquinolin-1-yl)ethenyl]benzonitrile Traditional Name: 4-[(E)-2-(6-hexoxy-3,4-dihydroisoquinolin-1-yl)vinyl]benzonitrile Formula: C24H26N2O MolecularWeight: 358.47604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC2=C(C=C1)C(=NCC2)C=CC3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCCCOC1=CC2=C(C=C1)C(=NCC2)/C=C/C3=CC=C(C=C3)C#N

InChI

InChI=1S/C24H26N2O/c1-2-3-4-5-16-27-22-11-12-23-21(17-22)14-15-26-24(23)13-10-19-6-8-20(18-25)9-7-19/h6-13,17H,2-5,14-16H2,1H3/b13-10+