4-methyl-3-(2-methylmorpholin-4-yl)sulfonyl-benzoic acid

Systemtic Name: 4-methyl-3-(2-methylmorpholin-4-yl)sulfonyl-benzoic acid Openeye Name: 4-methyl-3-(2-methylmorpholin-4-yl)sulfonyl-benzoic acid CAS Name: 4-methyl-3-[(2-methyl-4-morpholinyl)sulfonyl]benzoic acid IUPAC Name: 4-methyl-3-(2-methylmorpholin-4-yl)sulfonylbenzoic acid Traditional Name: 4-methyl-3-(2-methylmorpholino)sulfonyl-benzoic acid Formula: C13H17NO5S MolecularWeight: 299.34278

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCO1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)O)C

Isomeric SMILES

CC1CN(CCO1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)O)C

InChI

InChI=1S/C13H17NO5S/c1-9-3-4-11(13(15)16)7-12(9)20(17,18)14-5-6-19-10(2)8-14/h3-4,7,10H,5-6,8H2,1-2H3,(H,15,16)