3-[5-bromanyl-2-(naphthalen-2-ylmethoxy)phenyl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile

Systemtic Name: 3-[5-bromanyl-2-(naphthalen-2-ylmethoxy)phenyl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile Openeye Name: 3-[5-bromo-2-(2-naphthylmethoxy)phenyl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile CAS Name: 3-[5-bromo-2-(2-naphthalenylmethoxy)phenyl]-2-(6-methyl-1H-benzimidazol-2-yl)-2-propenenitrile IUPAC Name: 3-[5-bromo-2-(naphthalen-2-ylmethoxy)phenyl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile Traditional Name: 3-[5-bromo-2-(2-naphthylmethoxy)phenyl]-2-(6-methyl-1H-benzimidazol-2-yl)acrylonitrile Formula: C28H20BrN3O MolecularWeight: 494.3819

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)C(=CC3=C(C=CC(=C3)Br)OCC4=CC5=CC=CC=C5C=C4)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)C(=CC3=C(C=CC(=C3)Br)OCC4=CC5=CC=CC=C5C=C4)C#N

InChI

InChI=1S/C28H20BrN3O/c1-18-6-10-25-26(12-18)32-28(31-25)23(16-30)14-22-15-24(29)9-11-27(22)33-17-19-7-8-20-4-2-3-5-21(20)13-19/h2-15H,17H2,1H3,(H,31,32)