ethyl 3-(2-chlorophenyl)-2-cyano-3-thiophen-3-yl-butanoate

Systemtic Name: ethyl 3-(2-chlorophenyl)-2-cyano-3-thiophen-3-yl-butanoate Openeye Name: ethyl 3-(2-chlorophenyl)-2-cyano-3-(3-thienyl)butanoate CAS Name: 3-(2-chlorophenyl)-2-cyano-3-(3-thiophenyl)butanoic acid ethyl ester IUPAC Name: ethyl 3-(2-chlorophenyl)-2-cyano-3-thiophen-3-ylbutanoate Traditional Name: 3-(2-chlorophenyl)-2-cyano-3-(3-thienyl)butyric acid ethyl ester Formula: C17H16ClNO2S MolecularWeight: 333.83244

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C(C)(C1=CSC=C1)C2=CC=CC=C2Cl

Isomeric SMILES

CCOC(=O)C(C#N)C(C)(C1=CSC=C1)C2=CC=CC=C2Cl

InChI

InChI=1S/C17H16ClNO2S/c1-3-21-16(20)14(10-19)17(2,12-8-9-22-11-12)13-6-4-5-7-15(13)18/h4-9,11,14H,3H2,1-2H3