2-butan-2-yloxy-4-oxidanyl-5-(phenylcarbonyl)benzenesulfonic acid

Systemtic Name: 2-butan-2-yloxy-4-oxidanyl-5-(phenylcarbonyl)benzenesulfonic acid Openeye Name: 5-benzoyl-4-hydroxy-2-sec-butoxy-benzenesulfonic acid CAS Name: 5-benzoyl-2-butan-2-yloxy-4-hydroxybenzenesulfonic acid IUPAC Name: 5-benzoyl-2-butan-2-yloxy-4-hydroxybenzenesulfonic acid Traditional Name: 5-benzoyl-4-hydroxy-2-sec-butoxy-besylic acid Formula: C17H18O6S MolecularWeight: 350.38622

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=C(C=C(C(=C1)O)C(=O)C2=CC=CC=C2)S(=O)(=O)O

Isomeric SMILES

CCC(C)OC1=C(C=C(C(=C1)O)C(=O)C2=CC=CC=C2)S(=O)(=O)O

InChI

InChI=1S/C17H18O6S/c1-3-11(2)23-15-10-14(18)13(9-16(15)24(20,21)22)17(19)12-7-5-4-6-8-12/h4-11,18H,3H2,1-2H3,(H,20,21,22)