5-(2,2-dimethylmorpholin-4-yl)sulfonyl-2-methyl-benzoic acid

Systemtic Name: 5-(2,2-dimethylmorpholin-4-yl)sulfonyl-2-methyl-benzoic acid Openeye Name: 5-(2,2-dimethylmorpholin-4-yl)sulfonyl-2-methyl-benzoic acid CAS Name: 5-[(2,2-dimethyl-4-morpholinyl)sulfonyl]-2-methylbenzoic acid IUPAC Name: 5-(2,2-dimethylmorpholin-4-yl)sulfonyl-2-methylbenzoic acid Traditional Name: 5-(2,2-dimethylmorpholino)sulfonyl-2-methyl-benzoic acid Formula: C14H19NO5S MolecularWeight: 313.36936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOC(C2)(C)C)C(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOC(C2)(C)C)C(=O)O

InChI

InChI=1S/C14H19NO5S/c1-10-4-5-11(8-12(10)13(16)17)21(18,19)15-6-7-20-14(2,3)9-15/h4-5,8H,6-7,9H2,1-3H3,(H,16,17)