4-(2,2-dimethylmorpholin-4-yl)sulfonyl-1-methyl-pyrrole-2-carboxylic acid

Systemtic Name: 4-(2,2-dimethylmorpholin-4-yl)sulfonyl-1-methyl-pyrrole-2-carboxylic acid Openeye Name: 4-(2,2-dimethylmorpholin-4-yl)sulfonyl-1-methyl-pyrrole-2-carboxylic acid CAS Name: 4-[(2,2-dimethyl-4-morpholinyl)sulfonyl]-1-methyl-2-pyrrolecarboxylic acid IUPAC Name: 4-(2,2-dimethylmorpholin-4-yl)sulfonyl-1-methylpyrrole-2-carboxylic acid Traditional Name: 4-(2,2-dimethylmorpholino)sulfonyl-1-methyl-pyrrole-2-carboxylic acid Formula: C12H18N2O5S MolecularWeight: 302.34672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18N2O5S/c1-12(2)8-14(4-5-19-12)20(17,18)9-6-10(11(15)16)13(3)7-9/h6-7H,4-5,8H2,1-3H3,(H,15,16)