4-(2,5-dimethylmorpholin-4-yl)sulfonylbenzoic acid

Systemtic Name: 4-(2,5-dimethylmorpholin-4-yl)sulfonylbenzoic acid Openeye Name: 4-(2,5-dimethylmorpholin-4-yl)sulfonylbenzoic acid CAS Name: 4-[(2,5-dimethyl-4-morpholinyl)sulfonyl]benzoic acid IUPAC Name: 4-(2,5-dimethylmorpholin-4-yl)sulfonylbenzoic acid Traditional Name: 4-(2,5-dimethylmorpholino)sulfonylbenzoic acid Formula: C13H17NO5S MolecularWeight: 299.34278

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(CO1)C)S(=O)(=O)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC1CN(C(CO1)C)S(=O)(=O)C2=CC=C(C=C2)C(=O)O

InChI

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