2-[[4,5-bis(oxidanyl)-3-phosphonooxy-oxan-2-yl]amino]benzoate

Systemtic Name: 2-[[4,5-bis(oxidanyl)-3-phosphonooxy-oxan-2-yl]amino]benzoate Openeye Name: 2-[(4,5-dihydroxy-3-phosphonooxy-tetrahydropyran-2-yl)amino]benzoate CAS Name: 2-[(4,5-dihydroxy-3-phosphonooxy-2-oxanyl)amino]benzoate IUPAC Name: 2-[(4,5-dihydroxy-3-phosphonooxyoxan-2-yl)amino]benzoate Traditional Name: 2-[(4,5-dihydroxy-3-phosphonooxy-tetrahydropyran-2-yl)amino]benzoate Formula: C12H15NO9P- MolecularWeight: 348.222561

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C(O1)NC2=CC=CC=C2C(=O)[O-])OP(=O)(O)O)O)O

Isomeric SMILES

C1C(C(C(C(O1)NC2=CC=CC=C2C(=O)[O-])OP(=O)(O)O)O)O

InChI

InChI=1S/C12H16NO9P/c14-8-5-21-11(10(9(8)15)22-23(18,19)20)13-7-4-2-1-3-6(7)12(16)17/h1-4,8-11,13-15H,5H2,(H,16,17)(H2,18,19,20)/p-1