(2S,3S,4S,5R)-3,4,5-tris(oxidanyl)-6-[oxidanyl-(4-phenylphenyl)amino]oxane-2-carboxylic acid

Systemtic Name: (2S,3S,4S,5R)-3,4,5-tris(oxidanyl)-6-[oxidanyl-(4-phenylphenyl)amino]oxane-2-carboxylic acid Openeye Name: (2S,3S,4S,5R)-3,4,5-trihydroxy-6-(N-hydroxy-4-phenyl-anilino)tetrahydropyran-2-carboxylic acid CAS Name: (2S,3S,4S,5R)-3,4,5-trihydroxy-6-(N-hydroxy-4-phenylanilino)-2-oxanecarboxylic acid IUPAC Name: (2S,3S,4S,5R)-3,4,5-trihydroxy-6-(N-hydroxy-4-phenylanilino)oxane-2-carboxylic acid Traditional Name: (2S,3S,4S,5R)-3,4,5-trihydroxy-6-(N-hydroxy-4-phenyl-anilino)tetrahydropyran-2-carboxylic acid Formula: C18H19NO7 MolecularWeight: 361.34596

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)N(C3C(C(C(C(O3)C(=O)O)O)O)O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)N(C3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O)O

InChI

InChI=1S/C18H19NO7/c20-13-14(21)16(18(23)24)26-17(15(13)22)19(25)12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9,13-17,20-22,25H,(H,23,24)/t13-,14-,15+,16-,17?/m0/s1