(3-sulfonylcyclohexa-1,5-dien-1-yl) 4-oxidanylidenebutanoate

Systemtic Name: (3-sulfonylcyclohexa-1,5-dien-1-yl) 4-oxidanylidenebutanoate Openeye Name: (3-sulfonylcyclohexa-1,5-dien-1-yl) 4-oxobutanoate CAS Name: 4-oxobutanoic acid (3-sulfonyl-1-cyclohexa-1,5-dienyl) ester IUPAC Name: (3-sulfonylcyclohexa-1,5-dien-1-yl) 4-oxobutanoate Traditional Name: 4-ketobutyric acid (3-sulfonylcyclohexa-1,5-dien-1-yl) ester Formula: C10H10O5S MolecularWeight: 242.2484

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(=CC1=S(=O)=O)OC(=O)CCC=O

Isomeric SMILES

C1C=CC(=CC1=S(=O)=O)OC(=O)CCC=O

InChI

InChI=1S/C10H10O5S/c11-6-2-5-10(12)15-8-3-1-4-9(7-8)16(13)14/h1,3,6-7H,2,4-5H2