4-ethyl-3-(3-methylmorpholin-4-yl)sulfonyl-benzoic acid

Systemtic Name: 4-ethyl-3-(3-methylmorpholin-4-yl)sulfonyl-benzoic acid Openeye Name: 4-ethyl-3-(3-methylmorpholin-4-yl)sulfonyl-benzoic acid CAS Name: 4-ethyl-3-[(3-methyl-4-morpholinyl)sulfonyl]benzoic acid IUPAC Name: 4-ethyl-3-(3-methylmorpholin-4-yl)sulfonylbenzoic acid Traditional Name: 4-ethyl-3-(3-methylmorpholino)sulfonyl-benzoic acid Formula: C14H19NO5S MolecularWeight: 313.36936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)N2CCOCC2C

Isomeric SMILES

CCC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)N2CCOCC2C

InChI

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