4-(2-ethylmorpholin-4-yl)sulfonylbenzoic acid

Systemtic Name: 4-(2-ethylmorpholin-4-yl)sulfonylbenzoic acid Openeye Name: 4-(2-ethylmorpholin-4-yl)sulfonylbenzoic acid CAS Name: 4-[(2-ethyl-4-morpholinyl)sulfonyl]benzoic acid IUPAC Name: 4-(2-ethylmorpholin-4-yl)sulfonylbenzoic acid Traditional Name: 4-(2-ethylmorpholino)sulfonylbenzoic acid Formula: C13H17NO5S MolecularWeight: 299.34278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO5S/c1-2-11-9-14(7-8-19-11)20(17,18)12-5-3-10(4-6-12)13(15)16/h3-6,11H,2,7-9H2,1H3,(H,15,16)