(E)-3-(4-butoxy-3-ethoxy-phenyl)-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-(4-butoxy-3-ethoxy-phenyl)-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile Openeye Name: (E)-3-(4-butoxy-3-ethoxy-phenyl)-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile CAS Name: (E)-3-(4-butoxy-3-ethoxyphenyl)-2-(1-methyl-2-benzimidazolyl)-2-propenenitrile IUPAC Name: (E)-3-(4-butoxy-3-ethoxyphenyl)-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(4-butoxy-3-ethoxy-phenyl)-2-(1-methylbenzimidazol-2-yl)acrylonitrile Formula: C23H25N3O2 MolecularWeight: 375.4635

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=C(C#N)C2=NC3=CC=CC=C3N2C)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=C(\C#N)/C2=NC3=CC=CC=C3N2C)OCC

InChI

InChI=1S/C23H25N3O2/c1-4-6-13-28-21-12-11-17(15-22(21)27-5-2)14-18(16-24)23-25-19-9-7-8-10-20(19)26(23)3/h7-12,14-15H,4-6,13H2,1-3H3/b18-14+