[2-(5-ethylthiophen-2-yl)-2-oxidanylidene-ethyl] 4-cyanobenzoate

Systemtic Name: [2-(5-ethylthiophen-2-yl)-2-oxidanylidene-ethyl] 4-cyanobenzoate Openeye Name: [2-(5-ethyl-2-thienyl)-2-oxo-ethyl] 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid [2-(5-ethyl-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-ethylthiophen-2-yl)-2-oxoethyl] 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid [2-(5-ethyl-2-thienyl)-2-keto-ethyl] ester Formula: C16H13NO3S MolecularWeight: 299.34432

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C(=O)COC(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCC1=CC=C(S1)C(=O)COC(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C16H13NO3S/c1-2-13-7-8-15(21-13)14(18)10-20-16(19)12-5-3-11(9-17)4-6-12/h3-8H,2,10H2,1H3