(E)-2-(1H-benzimidazol-2-yl)-3-[4-(diethylamino)-2-phenylmethoxy-phenyl]prop-2-enenitrile

Systemtic Name: (E)-2-(1H-benzimidazol-2-yl)-3-[4-(diethylamino)-2-phenylmethoxy-phenyl]prop-2-enenitrile Openeye Name: (E)-2-(1H-benzimidazol-2-yl)-3-[2-benzyloxy-4-(diethylamino)phenyl]prop-2-enenitrile CAS Name: (E)-2-(1H-benzimidazol-2-yl)-3-[4-(diethylamino)-2-phenylmethoxyphenyl]-2-propenenitrile IUPAC Name: (E)-2-(1H-benzimidazol-2-yl)-3-[4-(diethylamino)-2-phenylmethoxyphenyl]prop-2-enenitrile Traditional Name: (E)-2-(1H-benzimidazol-2-yl)-3-[2-benzoxy-4-(diethylamino)phenyl]acrylonitrile Formula: C27H26N4O MolecularWeight: 422.52154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)C=C(C#N)C2=NC3=CC=CC=C3N2)OCC4=CC=CC=C4

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)/C=C(\C#N)/C2=NC3=CC=CC=C3N2)OCC4=CC=CC=C4

InChI

InChI=1S/C27H26N4O/c1-3-31(4-2)23-15-14-21(26(17-23)32-19-20-10-6-5-7-11-20)16-22(18-28)27-29-24-12-8-9-13-25(24)30-27/h5-17H,3-4,19H2,1-2H3,(H,29,30)/b22-16+