3-(4-azanylphenoxy)-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxane-2-thiolate

Systemtic Name: 3-(4-azanylphenoxy)-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxane-2-thiolate Openeye Name: 3-(4-aminophenoxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-thiolate CAS Name: 3-(4-aminophenoxy)-4,5-dihydroxy-6-(hydroxymethyl)-2-oxanethiolate IUPAC Name: 3-(4-aminophenoxy)-4,5-dihydroxy-6-(hydroxymethyl)oxane-2-thiolate Traditional Name: 3-(4-aminophenoxy)-4,5-dihydroxy-6-methylol-tetrahydropyran-2-thiolate Formula: C12H16NO5S- MolecularWeight: 286.32414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N)OC2C(C(C(OC2[S-])CO)O)O

Isomeric SMILES

C1=CC(=CC=C1N)OC2C(C(C(OC2[S-])CO)O)O

InChI

InChI=1S/C12H17NO5S/c13-6-1-3-7(4-2-6)17-11-10(16)9(15)8(5-14)18-12(11)19/h1-4,8-12,14-16,19H,5,13H2/p-1