6-[[4-(4-chloranylphenoxy)phenyl]-oxidanyl-amino]-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid; sodium

Systemtic Name: 6-[[4-(4-chloranylphenoxy)phenyl]-oxidanyl-amino]-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid; sodium Openeye Name: 6-[4-(4-chlorophenoxy)-N-hydroxy-anilino]-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid; sodium CAS Name: 6-[4-(4-chlorophenoxy)-N-hydroxyanilino]-3,4,5-trihydroxy-2-oxanecarboxylic acid; sodium IUPAC Name: 6-[4-(4-chlorophenoxy)-N-hydroxyanilino]-3,4,5-trihydroxyoxane-2-carboxylic acid; sodium Traditional Name: 6-[4-(4-chlorophenoxy)-N-hydroxy-anilino]-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid; sodium Formula: C18H18ClNNaO8 MolecularWeight: 434.78019

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N(C2C(C(C(C(O2)C(=O)O)O)O)O)O)OC3=CC=C(C=C3)Cl.[Na]

Isomeric SMILES

C1=CC(=CC=C1N(C2C(C(C(C(O2)C(=O)O)O)O)O)O)OC3=CC=C(C=C3)Cl.[Na]

InChI

InChI=1S/C18H18ClNO8.Na/c19-9-1-5-11(6-2-9)27-12-7-3-10(4-8-12)20(26)17-15(23)13(21)14(22)16(28-17)18(24)25;/h1-8,13-17,21-23,26H,(H,24,25);