3-(3-ethylmorpholin-4-yl)sulfonyl-4-methyl-benzoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1COCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)O)C

Isomeric SMILES

CCC1COCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)O)C

InChI

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