4-(5-ethyl-2-methyl-morpholin-4-yl)sulfonyl-1-methyl-pyrrole-2-carboxylic acid

Systemtic Name: 4-(5-ethyl-2-methyl-morpholin-4-yl)sulfonyl-1-methyl-pyrrole-2-carboxylic acid Openeye Name: 4-(5-ethyl-2-methyl-morpholin-4-yl)sulfonyl-1-methyl-pyrrole-2-carboxylic acid CAS Name: 4-[(5-ethyl-2-methyl-4-morpholinyl)sulfonyl]-1-methyl-2-pyrrolecarboxylic acid IUPAC Name: 4-(5-ethyl-2-methylmorpholin-4-yl)sulfonyl-1-methylpyrrole-2-carboxylic acid Traditional Name: 4-(5-ethyl-2-methyl-morpholino)sulfonyl-1-methyl-pyrrole-2-carboxylic acid Formula: C13H20N2O5S MolecularWeight: 316.3733

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2O5S/c1-4-10-8-20-9(2)6-15(10)21(18,19)11-5-12(13(16)17)14(3)7-11/h5,7,9-10H,4,6,8H2,1-3H3,(H,16,17)