(E)-2-(1H-benzimidazol-2-yl)-3-(4-bromanyl-5-iodanyl-furan-2-yl)prop-2-enenitrile

Systemtic Name: (E)-2-(1H-benzimidazol-2-yl)-3-(4-bromanyl-5-iodanyl-furan-2-yl)prop-2-enenitrile Openeye Name: (E)-2-(1H-benzimidazol-2-yl)-3-(4-bromo-5-iodo-2-furyl)prop-2-enenitrile CAS Name: (E)-2-(1H-benzimidazol-2-yl)-3-(4-bromo-5-iodo-2-furanyl)-2-propenenitrile IUPAC Name: (E)-2-(1H-benzimidazol-2-yl)-3-(4-bromo-5-iodofuran-2-yl)prop-2-enenitrile Traditional Name: (E)-2-(1H-benzimidazol-2-yl)-3-(4-bromo-5-iodo-2-furyl)acrylonitrile Formula: C14H7BrIN3O MolecularWeight: 440.03335

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)C(=CC3=CC(=C(O3)I)Br)C#N

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)/C(=C/C3=CC(=C(O3)I)Br)/C#N

InChI

InChI=1S/C14H7BrIN3O/c15-10-6-9(20-13(10)16)5-8(7-17)14-18-11-3-1-2-4-12(11)19-14/h1-6H,(H,18,19)/b8-5+