2-[4-(3-methylmorpholin-4-yl)sulfonylphenyl]ethanoic acid

Systemtic Name: 2-[4-(3-methylmorpholin-4-yl)sulfonylphenyl]ethanoic acid Openeye Name: 2-[4-(3-methylmorpholin-4-yl)sulfonylphenyl]acetic acid CAS Name: 2-[4-[(3-methyl-4-morpholinyl)sulfonyl]phenyl]acetic acid IUPAC Name: 2-[4-(3-methylmorpholin-4-yl)sulfonylphenyl]acetic acid Traditional Name: 2-[4-(3-methylmorpholino)sulfonylphenyl]acetic acid Formula: C13H17NO5S MolecularWeight: 299.34278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO5S/c1-10-9-19-7-6-14(10)20(17,18)12-4-2-11(3-5-12)8-13(15)16/h2-5,10H,6-9H2,1H3,(H,15,16)