ethyl 4-cyano-3,3-dimethyl-4-(phenylsulfonyl)butanoate

Systemtic Name: ethyl 4-cyano-3,3-dimethyl-4-(phenylsulfonyl)butanoate Openeye Name: ethyl 4-(benzenesulfonyl)-4-cyano-3,3-dimethyl-butanoate CAS Name: 4-(benzenesulfonyl)-4-cyano-3,3-dimethylbutanoic acid ethyl ester IUPAC Name: ethyl 4-(benzenesulfonyl)-4-cyano-3,3-dimethylbutanoate Traditional Name: 4-besyl-4-cyano-3,3-dimethyl-butyric acid ethyl ester Formula: C15H19NO4S MolecularWeight: 309.38066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO4S/c1-4-20-14(17)10-15(2,3)13(11-16)21(18,19)12-8-6-5-7-9-12/h5-9,13H,4,10H2,1-3H3