2-butoxy-4-oxidanyl-5-(phenylcarbonyl)benzenesulfonic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C(=C1)O)C(=O)C2=CC=CC=C2)S(=O)(=O)O

Isomeric SMILES

CCCCOC1=C(C=C(C(=C1)O)C(=O)C2=CC=CC=C2)S(=O)(=O)O

InChI

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