(E)-3-(3-bromanyl-1-benzothiophen-2-yl)-2-cyano-prop-2-enoic acid

Systemtic Name: (E)-3-(3-bromanyl-1-benzothiophen-2-yl)-2-cyano-prop-2-enoic acid Openeye Name: (E)-3-(3-bromobenzothiophen-2-yl)-2-cyano-prop-2-enoic acid CAS Name: (E)-3-(3-bromo-1-benzothiophen-2-yl)-2-cyano-2-propenoic acid IUPAC Name: (E)-3-(3-bromo-1-benzothiophen-2-yl)-2-cyanoprop-2-enoic acid Traditional Name: (E)-3-(3-bromobenzothiophen-2-yl)-2-cyano-acrylic acid Formula: C12H6BrNO2S MolecularWeight: 308.15054

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)C=C(C#N)C(=O)O)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)/C=C(\C#N)/C(=O)O)Br

InChI

InChI=1S/C12H6BrNO2S/c13-11-8-3-1-2-4-9(8)17-10(11)5-7(6-14)12(15)16/h1-5H,(H,15,16)/b7-5+