3-[(3-methylmorpholin-4-yl)sulfonylmethyl]benzoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1COCCN1S(=O)(=O)CC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CC1COCCN1S(=O)(=O)CC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C13H17NO5S/c1-10-8-19-6-5-14(10)20(17,18)9-11-3-2-4-12(7-11)13(15)16/h2-4,7,10H,5-6,8-9H2,1H3,(H,15,16)