(Z)-3-(1H-benzimidazol-2-yl)-2-(1,3-benzodioxol-5-yl)prop-2-enenitrile

Systemtic Name: (Z)-3-(1H-benzimidazol-2-yl)-2-(1,3-benzodioxol-5-yl)prop-2-enenitrile Openeye Name: (Z)-3-(1H-benzimidazol-2-yl)-2-(1,3-benzodioxol-5-yl)prop-2-enenitrile CAS Name: (Z)-3-(1H-benzimidazol-2-yl)-2-(1,3-benzodioxol-5-yl)-2-propenenitrile IUPAC Name: (Z)-3-(1H-benzimidazol-2-yl)-2-(1,3-benzodioxol-5-yl)prop-2-enenitrile Traditional Name: (Z)-3-(1H-benzimidazol-2-yl)-2-(1,3-benzodioxol-5-yl)acrylonitrile Formula: C17H11N3O2 MolecularWeight: 289.28814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=CC3=NC4=CC=CC=C4N3)C#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C(=C/C3=NC4=CC=CC=C4N3)/C#N

InChI

InChI=1S/C17H11N3O2/c18-9-12(11-5-6-15-16(7-11)22-10-21-15)8-17-19-13-3-1-2-4-14(13)20-17/h1-8H,10H2,(H,19,20)/b12-8+