3-oxidanylidenepropyl 4-sulfonylcyclohexa-1,5-diene-1-carboxylate

Systemtic Name: 3-oxidanylidenepropyl 4-sulfonylcyclohexa-1,5-diene-1-carboxylate Openeye Name: 3-oxopropyl 4-sulfonylcyclohexa-1,5-diene-1-carboxylate CAS Name: 4-sulfonyl-1-cyclohexa-1,5-dienecarboxylic acid 3-oxopropyl ester IUPAC Name: 3-oxopropyl 4-sulfonylcyclohexa-1,5-diene-1-carboxylate Traditional Name: 4-sulfonylcyclohexa-1,5-diene-1-carboxylic acid 3-ketopropyl ester Formula: C10H10O5S MolecularWeight: 242.2484

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(C=CC1=S(=O)=O)C(=O)OCCC=O

Isomeric SMILES

C1C=C(C=CC1=S(=O)=O)C(=O)OCCC=O

InChI

InChI=1S/C10H10O5S/c11-6-1-7-15-10(12)8-2-4-9(5-3-8)16(13)14/h2-4,6H,1,5,7H2