3-(3-bromanyl-4-phenylmethoxy-phenyl)-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile

Systemtic Name: 3-(3-bromanyl-4-phenylmethoxy-phenyl)-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile Openeye Name: 3-(4-benzyloxy-3-bromo-phenyl)-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile CAS Name: 3-(3-bromo-4-phenylmethoxyphenyl)-2-(6-methyl-1H-benzimidazol-2-yl)-2-propenenitrile IUPAC Name: 3-(3-bromo-4-phenylmethoxyphenyl)-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile Traditional Name: 3-(4-benzoxy-3-bromo-phenyl)-2-(6-methyl-1H-benzimidazol-2-yl)acrylonitrile Formula: C24H18BrN3O MolecularWeight: 444.32322

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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=CC=C4)Br)C#N

Isomeric SMILES

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

InChI

InChI=1S/C24H18BrN3O/c1-16-7-9-21-22(11-16)28-24(27-21)19(14-26)12-18-8-10-23(20(25)13-18)29-15-17-5-3-2-4-6-17/h2-13H,15H2,1H3,(H,27,28)