(E)-2-(1H-benzimidazol-2-yl)-3-[5-chloranyl-2-(pyridin-3-ylmethoxy)phenyl]prop-2-enenitrile

Systemtic Name: (E)-2-(1H-benzimidazol-2-yl)-3-[5-chloranyl-2-(pyridin-3-ylmethoxy)phenyl]prop-2-enenitrile Openeye Name: (E)-2-(1H-benzimidazol-2-yl)-3-[5-chloro-2-(3-pyridylmethoxy)phenyl]prop-2-enenitrile CAS Name: (E)-2-(1H-benzimidazol-2-yl)-3-[5-chloro-2-(3-pyridinylmethoxy)phenyl]-2-propenenitrile IUPAC Name: (E)-2-(1H-benzimidazol-2-yl)-3-[5-chloro-2-(pyridin-3-ylmethoxy)phenyl]prop-2-enenitrile Traditional Name: (E)-2-(1H-benzimidazol-2-yl)-3-[5-chloro-2-(3-pyridylmethoxy)phenyl]acrylonitrile Formula: C22H15ClN4O MolecularWeight: 386.8337

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)C(=CC3=C(C=CC(=C3)Cl)OCC4=CN=CC=C4)C#N

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)/C(=C/C3=C(C=CC(=C3)Cl)OCC4=CN=CC=C4)/C#N

InChI

InChI=1S/C22H15ClN4O/c23-18-7-8-21(28-14-15-4-3-9-25-13-15)16(11-18)10-17(12-24)22-26-19-5-1-2-6-20(19)27-22/h1-11,13H,14H2,(H,26,27)/b17-10+