3,4-dimethyl-5-(3-methylmorpholin-4-yl)sulfonyl-benzoic acid

Systemtic Name: 3,4-dimethyl-5-(3-methylmorpholin-4-yl)sulfonyl-benzoic acid Openeye Name: 3,4-dimethyl-5-(3-methylmorpholin-4-yl)sulfonyl-benzoic acid CAS Name: 3,4-dimethyl-5-[(3-methyl-4-morpholinyl)sulfonyl]benzoic acid IUPAC Name: 3,4-dimethyl-5-(3-methylmorpholin-4-yl)sulfonylbenzoic acid Traditional Name: 3,4-dimethyl-5-(3-methylmorpholino)sulfonyl-benzoic acid Formula: C14H19NO5S MolecularWeight: 313.36936

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Descriptors Computed from Structure

Canonical SMILES:

CC1COCCN1S(=O)(=O)C2=CC(=CC(=C2C)C)C(=O)O

Isomeric SMILES

CC1COCCN1S(=O)(=O)C2=CC(=CC(=C2C)C)C(=O)O

InChI

InChI=1S/C14H19NO5S/c1-9-6-12(14(16)17)7-13(11(9)3)21(18,19)15-4-5-20-8-10(15)2/h6-7,10H,4-5,8H2,1-3H3,(H,16,17)