3-[4-[(4-bromophenyl)methoxy]-3-methoxy-phenyl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile

Systemtic Name: 3-[4-[(4-bromophenyl)methoxy]-3-methoxy-phenyl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile Openeye Name: 3-[4-[(4-bromophenyl)methoxy]-3-methoxy-phenyl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile CAS Name: 3-[4-[(4-bromophenyl)methoxy]-3-methoxyphenyl]-2-(6-methyl-1H-benzimidazol-2-yl)-2-propenenitrile IUPAC Name: 3-[4-[(4-bromophenyl)methoxy]-3-methoxyphenyl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile Traditional Name: 3-[4-(4-bromobenzyl)oxy-3-methoxy-phenyl]-2-(6-methyl-1H-benzimidazol-2-yl)acrylonitrile Formula: C25H20BrN3O2 MolecularWeight: 474.3492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)C(=CC3=CC(=C(C=C3)OCC4=CC=C(C=C4)Br)OC)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)C(=CC3=CC(=C(C=C3)OCC4=CC=C(C=C4)Br)OC)C#N

InChI

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