3-(3-chloranyl-4-methoxy-phenyl)sulfonylpropanoic acid

Systemtic Name: 3-(3-chloranyl-4-methoxy-phenyl)sulfonylpropanoic acid Openeye Name: 3-(3-chloro-4-methoxy-phenyl)sulfonylpropanoic acid CAS Name: 3-(3-chloro-4-methoxyphenyl)sulfonylpropanoic acid IUPAC Name: 3-(3-chloro-4-methoxyphenyl)sulfonylpropanoic acid Traditional Name: 3-(3-chloro-4-methoxy-phenyl)sulfonylpropionic acid Formula: C10H11ClO5S MolecularWeight: 278.70934

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)CCC(=O)O)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)CCC(=O)O)Cl

InChI

InChI=1S/C10H11ClO5S/c1-16-9-3-2-7(6-8(9)11)17(14,15)5-4-10(12)13/h2-3,6H,4-5H2,1H3,(H,12,13)