3-(2-bromanyl-4,5-dimethoxy-phenyl)-2-(3,4-dimethoxyphenyl)propanenitrile

Systemtic Name: 3-(2-bromanyl-4,5-dimethoxy-phenyl)-2-(3,4-dimethoxyphenyl)propanenitrile Openeye Name: 3-(2-bromo-4,5-dimethoxy-phenyl)-2-(3,4-dimethoxyphenyl)propanenitrile CAS Name: 3-(2-bromo-4,5-dimethoxyphenyl)-2-(3,4-dimethoxyphenyl)propanenitrile IUPAC Name: 3-(2-bromo-4,5-dimethoxyphenyl)-2-(3,4-dimethoxyphenyl)propanenitrile Traditional Name: 3-(2-bromo-4,5-dimethoxy-phenyl)-2-(3,4-dimethoxyphenyl)propionitrile Formula: C19H20BrNO4 MolecularWeight: 406.2704

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC2=CC(=C(C=C2Br)OC)OC)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(CC2=CC(=C(C=C2Br)OC)OC)C#N)OC

InChI

InChI=1S/C19H20BrNO4/c1-22-16-6-5-12(8-17(16)23-2)14(11-21)7-13-9-18(24-3)19(25-4)10-15(13)20/h5-6,8-10,14H,7H2,1-4H3