3-[(2-ethylmorpholin-4-yl)sulfonylmethyl]benzoic acid

Systemtic Name: 3-[(2-ethylmorpholin-4-yl)sulfonylmethyl]benzoic acid Openeye Name: 3-[(2-ethylmorpholin-4-yl)sulfonylmethyl]benzoic acid CAS Name: 3-[(2-ethyl-4-morpholinyl)sulfonylmethyl]benzoic acid IUPAC Name: 3-[(2-ethylmorpholin-4-yl)sulfonylmethyl]benzoic acid Traditional Name: 3-[(2-ethylmorpholino)sulfonylmethyl]benzoic acid Formula: C14H19NO5S MolecularWeight: 313.36936

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CCO1)S(=O)(=O)CC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CCC1CN(CCO1)S(=O)(=O)CC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C14H19NO5S/c1-2-13-9-15(6-7-20-13)21(18,19)10-11-4-3-5-12(8-11)14(16)17/h3-5,8,13H,2,6-7,9-10H2,1H3,(H,16,17)