methyl (E)-3-(3-bromanyl-1-benzothiophen-2-yl)-2-cyano-prop-2-enoate

Systemtic Name: methyl (E)-3-(3-bromanyl-1-benzothiophen-2-yl)-2-cyano-prop-2-enoate Openeye Name: methyl (E)-3-(3-bromobenzothiophen-2-yl)-2-cyano-prop-2-enoate CAS Name: (E)-3-(3-bromo-1-benzothiophen-2-yl)-2-cyano-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-(3-bromo-1-benzothiophen-2-yl)-2-cyanoprop-2-enoate Traditional Name: (E)-3-(3-bromobenzothiophen-2-yl)-2-cyano-acrylic acid methyl ester Formula: C13H8BrNO2S MolecularWeight: 322.17712

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC1=C(C2=CC=CC=C2S1)Br)C#N

Isomeric SMILES

COC(=O)/C(=C/C1=C(C2=CC=CC=C2S1)Br)/C#N

InChI

InChI=1S/C13H8BrNO2S/c1-17-13(16)8(7-15)6-11-12(14)9-4-2-3-5-10(9)18-11/h2-6H,1H3/b8-6+