(E)-2-(1H-benzimidazol-2-yl)-3-[5-(5-chloranyl-2-methoxy-4-nitro-phenyl)furan-2-yl]prop-2-enenitrile

Systemtic Name: (E)-2-(1H-benzimidazol-2-yl)-3-[5-(5-chloranyl-2-methoxy-4-nitro-phenyl)furan-2-yl]prop-2-enenitrile Openeye Name: (E)-2-(1H-benzimidazol-2-yl)-3-[5-(5-chloro-2-methoxy-4-nitro-phenyl)-2-furyl]prop-2-enenitrile CAS Name: (E)-2-(1H-benzimidazol-2-yl)-3-[5-(5-chloro-2-methoxy-4-nitrophenyl)-2-furanyl]-2-propenenitrile IUPAC Name: (E)-2-(1H-benzimidazol-2-yl)-3-[5-(5-chloro-2-methoxy-4-nitrophenyl)furan-2-yl]prop-2-enenitrile Traditional Name: (E)-2-(1H-benzimidazol-2-yl)-3-[5-(5-chloro-2-methoxy-4-nitro-phenyl)-2-furyl]acrylonitrile Formula: C21H13ClN4O4 MolecularWeight: 420.80532

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C2=CC=C(O2)C=C(C#N)C3=NC4=CC=CC=C4N3)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1C2=CC=C(O2)/C=C(\C#N)/C3=NC4=CC=CC=C4N3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H13ClN4O4/c1-29-20-10-18(26(27)28)15(22)9-14(20)19-7-6-13(30-19)8-12(11-23)21-24-16-4-2-3-5-17(16)25-21/h2-10H,1H3,(H,24,25)/b12-8+