4-(2,2-dimethylmorpholin-4-yl)sulfonylbenzoic acid

Systemtic Name: 4-(2,2-dimethylmorpholin-4-yl)sulfonylbenzoic acid Openeye Name: 4-(2,2-dimethylmorpholin-4-yl)sulfonylbenzoic acid CAS Name: 4-[(2,2-dimethyl-4-morpholinyl)sulfonyl]benzoic acid IUPAC Name: 4-(2,2-dimethylmorpholin-4-yl)sulfonylbenzoic acid Traditional Name: 4-(2,2-dimethylmorpholino)sulfonylbenzoic acid Formula: C13H17NO5S MolecularWeight: 299.34278

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CCO1)S(=O)(=O)C2=CC=C(C=C2)C(=O)O)C

Isomeric SMILES

CC1(CN(CCO1)S(=O)(=O)C2=CC=C(C=C2)C(=O)O)C

InChI

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