ethyl 2-(5-cyano-1-benzothiophen-3-yl)ethanoate

Systemtic Name: ethyl 2-(5-cyano-1-benzothiophen-3-yl)ethanoate Openeye Name: ethyl 2-(5-cyanobenzothiophen-3-yl)acetate CAS Name: 2-(5-cyano-1-benzothiophen-3-yl)acetic acid ethyl ester IUPAC Name: ethyl 2-(5-cyano-1-benzothiophen-3-yl)acetate Traditional Name: 2-(5-cyanobenzothiophen-3-yl)acetic acid ethyl ester Formula: C13H11NO2S MolecularWeight: 245.29694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC2=C1C=C(C=C2)C#N

Isomeric SMILES

CCOC(=O)CC1=CSC2=C1C=C(C=C2)C#N

InChI

InChI=1S/C13H11NO2S/c1-2-16-13(15)6-10-8-17-12-4-3-9(7-14)5-11(10)12/h3-5,8H,2,6H2,1H3