4-(5-ethyl-2-methyl-morpholin-4-yl)sulfonylbenzoic acid

Systemtic Name: 4-(5-ethyl-2-methyl-morpholin-4-yl)sulfonylbenzoic acid Openeye Name: 4-(5-ethyl-2-methyl-morpholin-4-yl)sulfonylbenzoic acid CAS Name: 4-[(5-ethyl-2-methyl-4-morpholinyl)sulfonyl]benzoic acid IUPAC Name: 4-(5-ethyl-2-methylmorpholin-4-yl)sulfonylbenzoic acid Traditional Name: 4-(5-ethyl-2-methyl-morpholino)sulfonylbenzoic acid Formula: C14H19NO5S MolecularWeight: 313.36936

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Descriptors Computed from Structure

Canonical SMILES:

CCC1COC(CN1S(=O)(=O)C2=CC=C(C=C2)C(=O)O)C

Isomeric SMILES

CCC1COC(CN1S(=O)(=O)C2=CC=C(C=C2)C(=O)O)C

InChI

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