5-[3-(4-chloranylphenoxy)-2-methyl-propanoyl]oxy-2-oxidanyl-benzenesulfonic acid

Systemtic Name: 5-[3-(4-chloranylphenoxy)-2-methyl-propanoyl]oxy-2-oxidanyl-benzenesulfonic acid Openeye Name: 5-[3-(4-chlorophenoxy)-2-methyl-propanoyl]oxy-2-hydroxy-benzenesulfonic acid CAS Name: 5-[3-(4-chlorophenoxy)-2-methyl-1-oxopropoxy]-2-hydroxybenzenesulfonic acid IUPAC Name: 5-[3-(4-chlorophenoxy)-2-methylpropanoyl]oxy-2-hydroxybenzenesulfonic acid Traditional Name: 5-[3-(4-chlorophenoxy)-2-methyl-propanoyl]oxy-2-hydroxy-besylic acid Formula: C16H15ClO7S MolecularWeight: 386.8041

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=CC=C(C=C1)Cl)C(=O)OC2=CC(=C(C=C2)O)S(=O)(=O)O

Isomeric SMILES

CC(COC1=CC=C(C=C1)Cl)C(=O)OC2=CC(=C(C=C2)O)S(=O)(=O)O

InChI

InChI=1S/C16H15ClO7S/c1-10(9-23-12-4-2-11(17)3-5-12)16(19)24-13-6-7-14(18)15(8-13)25(20,21)22/h2-8,10,18H,9H2,1H3,(H,20,21,22)