2,5-bis(chloranyl)-3-(3-methylmorpholin-4-yl)sulfonyl-benzoic acid

Systemtic Name: 2,5-bis(chloranyl)-3-(3-methylmorpholin-4-yl)sulfonyl-benzoic acid Openeye Name: 2,5-dichloro-3-(3-methylmorpholin-4-yl)sulfonyl-benzoic acid CAS Name: 2,5-dichloro-3-[(3-methyl-4-morpholinyl)sulfonyl]benzoic acid IUPAC Name: 2,5-dichloro-3-(3-methylmorpholin-4-yl)sulfonylbenzoic acid Traditional Name: 2,5-dichloro-3-(3-methylmorpholino)sulfonyl-benzoic acid Formula: C12H13Cl2NO5S MolecularWeight: 354.20632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1COCCN1S(=O)(=O)C2=C(C(=CC(=C2)Cl)C(=O)O)Cl

Isomeric SMILES

CC1COCCN1S(=O)(=O)C2=C(C(=CC(=C2)Cl)C(=O)O)Cl

InChI

InChI=1S/C12H13Cl2NO5S/c1-7-6-20-3-2-15(7)21(18,19)10-5-8(13)4-9(11(10)14)12(16)17/h4-5,7H,2-3,6H2,1H3,(H,16,17)