(E)-3-[4-[(4-bromophenyl)methoxy]-3-methoxy-phenyl]-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-[4-[(4-bromophenyl)methoxy]-3-methoxy-phenyl]-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile Openeye Name: (E)-3-[4-[(4-bromophenyl)methoxy]-3-methoxy-phenyl]-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile CAS Name: (E)-3-[4-[(4-bromophenyl)methoxy]-3-methoxyphenyl]-2-(1-methyl-2-benzimidazolyl)-2-propenenitrile IUPAC Name: (E)-3-[4-[(4-bromophenyl)methoxy]-3-methoxyphenyl]-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile Traditional Name: (E)-3-[4-(4-bromobenzyl)oxy-3-methoxy-phenyl]-2-(1-methylbenzimidazol-2-yl)acrylonitrile Formula: C25H20BrN3O2 MolecularWeight: 474.3492

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1C(=CC3=CC(=C(C=C3)OCC4=CC=C(C=C4)Br)OC)C#N

Isomeric SMILES

CN1C2=CC=CC=C2N=C1/C(=C/C3=CC(=C(C=C3)OCC4=CC=C(C=C4)Br)OC)/C#N

InChI

InChI=1S/C25H20BrN3O2/c1-29-22-6-4-3-5-21(22)28-25(29)19(15-27)13-18-9-12-23(24(14-18)30-2)31-16-17-7-10-20(26)11-8-17/h3-14H,16H2,1-2H3/b19-13+