(E)-3-(2-bromanyl-4,5-dimethoxy-phenyl)-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-(2-bromanyl-4,5-dimethoxy-phenyl)-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile Openeye Name: (E)-3-(2-bromo-4,5-dimethoxy-phenyl)-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile CAS Name: (E)-3-(2-bromo-4,5-dimethoxyphenyl)-2-(1-methyl-2-benzimidazolyl)-2-propenenitrile IUPAC Name: (E)-3-(2-bromo-4,5-dimethoxyphenyl)-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(2-bromo-4,5-dimethoxy-phenyl)-2-(1-methylbenzimidazol-2-yl)acrylonitrile Formula: C19H16BrN3O2 MolecularWeight: 398.25324

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1C(=CC3=CC(=C(C=C3Br)OC)OC)C#N

Isomeric SMILES

CN1C2=CC=CC=C2N=C1/C(=C/C3=CC(=C(C=C3Br)OC)OC)/C#N

InChI

InChI=1S/C19H16BrN3O2/c1-23-16-7-5-4-6-15(16)22-19(23)13(11-21)8-12-9-17(24-2)18(25-3)10-14(12)20/h4-10H,1-3H3/b13-8+