3-methylbutyl 4-chloranylsulfonyloxy-2-oxidanyl-benzoate

Systemtic Name: 3-methylbutyl 4-chloranylsulfonyloxy-2-oxidanyl-benzoate Openeye Name: isopentyl 4-chlorosulfonyloxy-2-hydroxy-benzoate CAS Name: 4-chlorosulfonyloxy-2-hydroxybenzoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 4-chlorosulfonyloxy-2-hydroxybenzoate Traditional Name: 4-chlorosulfonyloxy-2-hydroxy-benzoic acid isoamyl ester Formula: C12H15ClO6S MolecularWeight: 322.7619

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)C1=C(C=C(C=C1)OS(=O)(=O)Cl)O

Isomeric SMILES

CC(C)CCOC(=O)C1=C(C=C(C=C1)OS(=O)(=O)Cl)O

InChI

InChI=1S/C12H15ClO6S/c1-8(2)5-6-18-12(15)10-4-3-9(7-11(10)14)19-20(13,16)17/h3-4,7-8,14H,5-6H2,1-2H3