3-methoxy-4-methyl-5-morpholin-4-ylsulfonyl-benzoic acid

Systemtic Name: 3-methoxy-4-methyl-5-morpholin-4-ylsulfonyl-benzoic acid Openeye Name: 3-methoxy-4-methyl-5-morpholinosulfonyl-benzoic acid CAS Name: 3-methoxy-4-methyl-5-(4-morpholinylsulfonyl)benzoic acid IUPAC Name: 3-methoxy-4-methyl-5-morpholin-4-ylsulfonylbenzoic acid Traditional Name: 3-methoxy-4-methyl-5-morpholinosulfonyl-benzoic acid Formula: C13H17NO6S MolecularWeight: 315.34218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1S(=O)(=O)N2CCOCC2)C(=O)O)OC

Isomeric SMILES

CC1=C(C=C(C=C1S(=O)(=O)N2CCOCC2)C(=O)O)OC

InChI

InChI=1S/C13H17NO6S/c1-9-11(19-2)7-10(13(15)16)8-12(9)21(17,18)14-3-5-20-6-4-14/h7-8H,3-6H2,1-2H3,(H,15,16)