(2R,3S,4R,5R)-2,3,4,5,6-pentakis(oxidanyl)hexanoate; quinolin-1-ium

Systemtic Name: (2R,3S,4R,5R)-2,3,4,5,6-pentakis(oxidanyl)hexanoate; quinolin-1-ium Openeye Name: (2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoate; quinolin-1-ium CAS Name: (2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoate; quinolin-1-ium IUPAC Name: (2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoate; quinolin-1-ium Traditional Name: (2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoate; quinolin-1-ium Formula: C15H19NO7 MolecularWeight: 325.31386

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=[NH+]2.C(C(C(C(C(C(=O)[O-])O)O)O)O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=[NH+]2.C([C@H]([C@H]([C@@H]([C@H](C(=O)[O-])O)O)O)O)O

InChI

InChI=1S/C9H7N.C6H12O7/c1-2-6-9-8(4-1)5-3-7-10-9;7-1-2(8)3(9)4(10)5(11)6(12)13/h1-7H;2-5,7-11H,1H2,(H,12,13)/t;2-,3-,4+,5-/m.1/s1