2-(3-oxidanylidenebutylsulfonyl)ethyl benzoate

Systemtic Name: 2-(3-oxidanylidenebutylsulfonyl)ethyl benzoate Openeye Name: 2-(3-oxobutylsulfonyl)ethyl benzoate CAS Name: benzoic acid 2-(3-oxobutylsulfonyl)ethyl ester IUPAC Name: 2-(3-oxobutylsulfonyl)ethyl benzoate Traditional Name: benzoic acid 2-(3-ketobutylsulfonyl)ethyl ester Formula: C13H16O5S MolecularWeight: 284.32814

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCS(=O)(=O)CCOC(=O)C1=CC=CC=C1

Isomeric SMILES

CC(=O)CCS(=O)(=O)CCOC(=O)C1=CC=CC=C1

InChI

InChI=1S/C13H16O5S/c1-11(14)7-9-19(16,17)10-8-18-13(15)12-5-3-2-4-6-12/h2-6H,7-10H2,1H3