(E)-3-[5-(2-bromophenyl)furan-2-yl]-2-(3,4-dimethoxyphenyl)prop-2-enenitrile

Systemtic Name: (E)-3-[5-(2-bromophenyl)furan-2-yl]-2-(3,4-dimethoxyphenyl)prop-2-enenitrile Openeye Name: (E)-3-[5-(2-bromophenyl)-2-furyl]-2-(3,4-dimethoxyphenyl)prop-2-enenitrile CAS Name: (E)-3-[5-(2-bromophenyl)-2-furanyl]-2-(3,4-dimethoxyphenyl)-2-propenenitrile IUPAC Name: (E)-3-[5-(2-bromophenyl)furan-2-yl]-2-(3,4-dimethoxyphenyl)prop-2-enenitrile Traditional Name: (E)-3-[5-(2-bromophenyl)-2-furyl]-2-(3,4-dimethoxyphenyl)acrylonitrile Formula: C21H16BrNO3 MolecularWeight: 410.26064

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=CC2=CC=C(O2)C3=CC=CC=C3Br)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C(=C\C2=CC=C(O2)C3=CC=CC=C3Br)/C#N)OC

InChI

InChI=1S/C21H16BrNO3/c1-24-20-9-7-14(12-21(20)25-2)15(13-23)11-16-8-10-19(26-16)17-5-3-4-6-18(17)22/h3-12H,1-2H3/b15-11-