3-[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethoxy]benzenecarbonitrile

Systemtic Name: 3-[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethoxy]benzenecarbonitrile Openeye Name: 3-[2-(5-bromo-2-thienyl)-2-oxo-ethoxy]benzonitrile CAS Name: 3-[2-(5-bromo-2-thiophenyl)-2-oxoethoxy]benzonitrile IUPAC Name: 3-[2-(5-bromothiophen-2-yl)-2-oxoethoxy]benzonitrile Traditional Name: 3-[2-(5-bromo-2-thienyl)-2-keto-ethoxy]benzonitrile Formula: C13H8BrNO2S MolecularWeight: 322.17712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC(=O)C2=CC=C(S2)Br)C#N

Isomeric SMILES

C1=CC(=CC(=C1)OCC(=O)C2=CC=C(S2)Br)C#N

InChI

InChI=1S/C13H8BrNO2S/c14-13-5-4-12(18-13)11(16)8-17-10-3-1-2-9(6-10)7-15/h1-6H,8H2