4-(4-chloranylphenoxy)-6-ethoxy-2-(phenylsulfonylamino)oxane-3-carboxylic acid

Systemtic Name: 4-(4-chloranylphenoxy)-6-ethoxy-2-(phenylsulfonylamino)oxane-3-carboxylic acid Openeye Name: 2-(benzenesulfonamido)-4-(4-chlorophenoxy)-6-ethoxy-tetrahydropyran-3-carboxylic acid CAS Name: 2-(benzenesulfonamido)-4-(4-chlorophenoxy)-6-ethoxy-3-oxanecarboxylic acid IUPAC Name: 2-(benzenesulfonamido)-4-(4-chlorophenoxy)-6-ethoxyoxane-3-carboxylic acid Traditional Name: 2-(benzenesulfonamido)-4-(4-chlorophenoxy)-6-ethoxy-tetrahydropyran-3-carboxylic acid Formula: C20H22ClNO7S MolecularWeight: 455.90918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1CC(C(C(O1)NS(=O)(=O)C2=CC=CC=C2)C(=O)O)OC3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC1CC(C(C(O1)NS(=O)(=O)C2=CC=CC=C2)C(=O)O)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H22ClNO7S/c1-2-27-17-12-16(28-14-10-8-13(21)9-11-14)18(20(23)24)19(29-17)22-30(25,26)15-6-4-3-5-7-15/h3-11,16-19,22H,2,12H2,1H3,(H,23,24)