5-(azetidin-1-ylsulfonyl)-2,3-dimethoxy-benzoic acid

Systemtic Name: 5-(azetidin-1-ylsulfonyl)-2,3-dimethoxy-benzoic acid Openeye Name: 5-(azetidin-1-ylsulfonyl)-2,3-dimethoxy-benzoic acid CAS Name: 5-(1-azetidinylsulfonyl)-2,3-dimethoxybenzoic acid IUPAC Name: 5-(azetidin-1-ylsulfonyl)-2,3-dimethoxybenzoic acid Traditional Name: 5-(azetidin-1-ylsulfonyl)-2,3-dimethoxy-benzoic acid Formula: C12H15NO6S MolecularWeight: 301.3156

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)S(=O)(=O)N2CCC2)C(=O)O)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)S(=O)(=O)N2CCC2)C(=O)O)OC

InChI

InChI=1S/C12H15NO6S/c1-18-10-7-8(20(16,17)13-4-3-5-13)6-9(12(14)15)11(10)19-2/h6-7H,3-5H2,1-2H3,(H,14,15)