(E)-3-(4-bromanylthiophen-2-yl)-2-(3-methoxyphenyl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(4-bromanylthiophen-2-yl)-2-(3-methoxyphenyl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(4-bromo-2-thienyl)-2-(3-methoxybenzoyl)prop-2-enenitrile CAS Name: (E)-3-(4-bromo-2-thiophenyl)-2-[(3-methoxyphenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(4-bromothiophen-2-yl)-2-(3-methoxybenzoyl)prop-2-enenitrile Traditional Name: (E)-3-(4-bromo-2-thienyl)-2-m-anisoyl-acrylonitrile Formula: C15H10BrNO2S MolecularWeight: 348.2144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)C(=CC2=CC(=CS2)Br)C#N

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)/C(=C/C2=CC(=CS2)Br)/C#N

InChI

InChI=1S/C15H10BrNO2S/c1-19-13-4-2-3-10(5-13)15(18)11(8-17)6-14-7-12(16)9-20-14/h2-7,9H,1H3/b11-6+