ethyl 2-cyano-2-(phenylsulfonyl)ethanoate

Systemtic Name: ethyl 2-cyano-2-(phenylsulfonyl)ethanoate Openeye Name: ethyl 2-(benzenesulfonyl)-2-cyano-acetate CAS Name: 2-(benzenesulfonyl)-2-cyanoacetic acid ethyl ester IUPAC Name: ethyl 2-(benzenesulfonyl)-2-cyanoacetate Traditional Name: 2-besyl-2-cyano-acetic acid ethyl ester Formula: C11H11NO4S MolecularWeight: 253.27434

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)S(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

CCOC(=O)C(C#N)S(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C11H11NO4S/c1-2-16-11(13)10(8-12)17(14,15)9-6-4-3-5-7-9/h3-7,10H,2H2,1H3