2-chloranyl-3-ethoxy-4-ethylsulfonyl-benzoic acid

Systemtic Name: 2-chloranyl-3-ethoxy-4-ethylsulfonyl-benzoic acid Openeye Name: 2-chloro-3-ethoxy-4-ethylsulfonyl-benzoic acid CAS Name: 2-chloro-3-ethoxy-4-ethylsulfonylbenzoic acid IUPAC Name: 2-chloro-3-ethoxy-4-ethylsulfonylbenzoic acid Traditional Name: 2-chloro-4-esyl-3-ethoxy-benzoic acid Formula: C11H13ClO5S MolecularWeight: 292.73592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1Cl)C(=O)O)S(=O)(=O)CC

Isomeric SMILES

CCOC1=C(C=CC(=C1Cl)C(=O)O)S(=O)(=O)CC

InChI

InChI=1S/C11H13ClO5S/c1-3-17-10-8(18(15,16)4-2)6-5-7(9(10)12)11(13)14/h5-6H,3-4H2,1-2H3,(H,13,14)