2-methoxy-4-(oxolan-2-ylmethylsulfinamoyl)benzoic acid

Systemtic Name: 2-methoxy-4-(oxolan-2-ylmethylsulfinamoyl)benzoic acid Openeye Name: 2-methoxy-4-(tetrahydrofuran-2-ylmethylsulfinamoyl)benzoic acid CAS Name: 2-methoxy-4-(2-oxolanylmethylsulfinamoyl)benzoic acid IUPAC Name: 2-methoxy-4-(oxolan-2-ylmethylsulfinamoyl)benzoic acid Traditional Name: 2-methoxy-4-(tetrahydrofurfurylsulfinamoyl)benzoic acid Formula: C13H17NO5S MolecularWeight: 299.34278

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)S(=O)NCC2CCCO2)C(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)S(=O)NCC2CCCO2)C(=O)O

InChI

InChI=1S/C13H17NO5S/c1-18-12-7-10(4-5-11(12)13(15)16)20(17)14-8-9-3-2-6-19-9/h4-5,7,9,14H,2-3,6,8H2,1H3,(H,15,16)