2-oxidanylidenepentyl 4-methoxybenzenesulfonate

Systemtic Name: 2-oxidanylidenepentyl 4-methoxybenzenesulfonate Openeye Name: 2-oxopentyl 4-methoxybenzenesulfonate CAS Name: 4-methoxybenzenesulfonic acid 2-oxopentyl ester IUPAC Name: 2-oxopentyl 4-methoxybenzenesulfonate Traditional Name: 4-methoxybenzenesulfonic acid 2-ketopentyl ester Formula: C12H16O5S MolecularWeight: 272.31744

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)COS(=O)(=O)C1=CC=C(C=C1)OC

Isomeric SMILES

CCCC(=O)COS(=O)(=O)C1=CC=C(C=C1)OC

InChI

InChI=1S/C12H16O5S/c1-3-4-10(13)9-17-18(14,15)12-7-5-11(16-2)6-8-12/h5-8H,3-4,9H2,1-2H3