6-(hydroxymethyl)-3-naphthalen-1-yloxy-4,5-bis(oxidanyl)oxan-2-olate hydrate

Systemtic Name: 6-(hydroxymethyl)-3-naphthalen-1-yloxy-4,5-bis(oxidanyl)oxan-2-olate hydrate Openeye Name: 4,5-dihydroxy-6-(hydroxymethyl)-3-(1-naphthyloxy)tetrahydropyran-2-olate hydrate CAS Name: 4,5-dihydroxy-6-(hydroxymethyl)-3-(1-naphthalenyloxy)-2-oxanolate hydrate IUPAC Name: 4,5-dihydroxy-6-(hydroxymethyl)-3-naphthalen-1-yloxyoxan-2-olate hydrate Traditional Name: 4,5-dihydroxy-6-methylol-3-(1-naphthoxy)tetrahydropyran-2-olate hydrate Formula: C16H19O7- MolecularWeight: 323.31786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2OC3C(C(C(OC3[O-])CO)O)O.O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2OC3C(C(C(OC3[O-])CO)O)O.O

InChI

InChI=1S/C16H17O6.H2O/c17-8-12-13(18)14(19)15(16(20)22-12)21-11-7-3-5-9-4-1-2-6-10(9)11;/h1-7,12-19H,8H2;1H2/q-1;