4-[(Z)-(2-pentyl-1,4-benzodioxin-3-ylidene)methyl]benzenecarbonitrile

Systemtic Name: 4-[(Z)-(2-pentyl-1,4-benzodioxin-3-ylidene)methyl]benzenecarbonitrile Openeye Name: 4-[(Z)-(2-pentyl-1,4-benzodioxin-3-ylidene)methyl]benzonitrile CAS Name: 4-[(Z)-(2-pentyl-1,4-benzodioxin-3-ylidene)methyl]benzonitrile IUPAC Name: 4-[(Z)-(2-pentyl-1,4-benzodioxin-3-ylidene)methyl]benzonitrile Traditional Name: 4-[(Z)-(2-amyl-1,4-benzodioxin-3-ylidene)methyl]benzonitrile Formula: C21H21NO2 MolecularWeight: 319.39694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1C(=CC2=CC=C(C=C2)C#N)OC3=CC=CC=C3O1

Isomeric SMILES

CCCCCC1/C(=C/C2=CC=C(C=C2)C#N)/OC3=CC=CC=C3O1

InChI

InChI=1S/C21H21NO2/c1-2-3-4-7-20-21(14-16-10-12-17(15-22)13-11-16)24-19-9-6-5-8-18(19)23-20/h5-6,8-14,20H,2-4,7H2,1H3/b21-14-