methyl (E)-3-(2-cyano-1-benzothiophen-5-yl)prop-2-enoate

Systemtic Name: methyl (E)-3-(2-cyano-1-benzothiophen-5-yl)prop-2-enoate Openeye Name: methyl (E)-3-(2-cyanobenzothiophen-5-yl)prop-2-enoate CAS Name: (E)-3-(2-cyano-1-benzothiophen-5-yl)-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-(2-cyano-1-benzothiophen-5-yl)prop-2-enoate Traditional Name: (E)-3-(2-cyanobenzothiophen-5-yl)acrylic acid methyl ester Formula: C13H9NO2S MolecularWeight: 243.28106

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC1=CC2=C(C=C1)SC(=C2)C#N

Isomeric SMILES

COC(=O)/C=C/C1=CC2=C(C=C1)SC(=C2)C#N

InChI

InChI=1S/C13H9NO2S/c1-16-13(15)5-3-9-2-4-12-10(6-9)7-11(8-14)17-12/h2-7H,1H3/b5-3+