(E)-2-(1H-benzimidazol-2-yl)-3-[3,5-bis(iodanyl)-2-prop-2-enoxy-phenyl]prop-2-enenitrile

Systemtic Name: (E)-2-(1H-benzimidazol-2-yl)-3-[3,5-bis(iodanyl)-2-prop-2-enoxy-phenyl]prop-2-enenitrile Openeye Name: (E)-3-(2-allyloxy-3,5-diiodo-phenyl)-2-(1H-benzimidazol-2-yl)prop-2-enenitrile CAS Name: (E)-2-(1H-benzimidazol-2-yl)-3-(3,5-diiodo-2-prop-2-enoxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-(1H-benzimidazol-2-yl)-3-(3,5-diiodo-2-prop-2-enoxyphenyl)prop-2-enenitrile Traditional Name: (E)-3-(2-allyloxy-3,5-diiodo-phenyl)-2-(1H-benzimidazol-2-yl)acrylonitrile Formula: C19H13I2N3O MolecularWeight: 553.13496

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=C(C=C(C=C1C=C(C#N)C2=NC3=CC=CC=C3N2)I)I

Isomeric SMILES

C=CCOC1=C(C=C(C=C1/C=C(\C#N)/C2=NC3=CC=CC=C3N2)I)I

InChI

InChI=1S/C19H13I2N3O/c1-2-7-25-18-12(9-14(20)10-15(18)21)8-13(11-22)19-23-16-5-3-4-6-17(16)24-19/h2-6,8-10H,1,7H2,(H,23,24)/b13-8+