4-[2-(3-bromanyl-5-ethoxy-4-phenylmethoxy-phenyl)-1-cyano-ethenyl]benzenecarbonitrile

Systemtic Name: 4-[2-(3-bromanyl-5-ethoxy-4-phenylmethoxy-phenyl)-1-cyano-ethenyl]benzenecarbonitrile Openeye Name: 4-[2-(4-benzyloxy-3-bromo-5-ethoxy-phenyl)-1-cyano-vinyl]benzonitrile CAS Name: 4-[2-(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)-1-cyanoethenyl]benzonitrile IUPAC Name: 4-[2-(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)-1-cyanoethenyl]benzonitrile Traditional Name: 4-[2-(4-benzoxy-3-bromo-5-ethoxy-phenyl)-1-cyano-vinyl]benzonitrile Formula: C25H19BrN2O2 MolecularWeight: 459.33456

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C(C#N)C2=CC=C(C=C2)C#N)Br)OCC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=C(C#N)C2=CC=C(C=C2)C#N)Br)OCC3=CC=CC=C3

InChI

InChI=1S/C25H19BrN2O2/c1-2-29-24-14-20(12-22(16-28)21-10-8-18(15-27)9-11-21)13-23(26)25(24)30-17-19-6-4-3-5-7-19/h3-14H,2,17H2,1H3