4-[(3-ethoxy-3-oxidanylidene-propyl)-[4-(4-fluoranylphenoxy)phenyl]sulfonyl-amino]oxane-4-carboxylic acid

Systemtic Name: 4-[(3-ethoxy-3-oxidanylidene-propyl)-[4-(4-fluoranylphenoxy)phenyl]sulfonyl-amino]oxane-4-carboxylic acid Openeye Name: 4-[(3-ethoxy-3-oxo-propyl)-[4-(4-fluorophenoxy)phenyl]sulfonyl-amino]tetrahydropyran-4-carboxylic acid CAS Name: 4-[(3-ethoxy-3-oxopropyl)-[4-(4-fluorophenoxy)phenyl]sulfonylamino]-4-oxanecarboxylic acid IUPAC Name: 4-[(3-ethoxy-3-oxopropyl)-[4-(4-fluorophenoxy)phenyl]sulfonylamino]oxane-4-carboxylic acid Traditional Name: 4-[(3-ethoxy-3-keto-propyl)-[4-(4-fluorophenoxy)phenyl]sulfonyl-amino]tetrahydropyran-4-carboxylic acid Formula: C23H26FNO8S MolecularWeight: 495.517843

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(C1(CCOCC1)C(=O)O)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)CCN(C1(CCOCC1)C(=O)O)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)F

InChI

InChI=1S/C23H26FNO8S/c1-2-32-21(26)11-14-25(23(22(27)28)12-15-31-16-13-23)34(29,30)20-9-7-19(8-10-20)33-18-5-3-17(24)4-6-18/h3-10H,2,11-16H2,1H3,(H,27,28)