(1S,3R)-1-(aminomethyl)-3-(hydroxymethyl)-3,4-dihydro-1H-isochromene-5,6-diol

Systemtic Name: (1S,3R)-1-(aminomethyl)-3-(hydroxymethyl)-3,4-dihydro-1H-isochromene-5,6-diol Openeye Name: (1S,3R)-1-(aminomethyl)-3-(hydroxymethyl)isochromane-5,6-diol CAS Name: (1S,3R)-1-(aminomethyl)-3-(hydroxymethyl)-3,4-dihydro-1H-2-benzopyran-5,6-diol IUPAC Name: (1S,3R)-1-(aminomethyl)-3-(hydroxymethyl)-3,4-dihydro-1H-isochromene-5,6-diol Traditional Name: (1S,3R)-1-(aminomethyl)-3-methylol-isochroman-5,6-diol Formula: C11H15NO4 MolecularWeight: 225.2411

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(C2=C1C(=C(C=C2)O)O)CN)CO

Isomeric SMILES

C1[C@@H](O[C@@H](C2=C1C(=C(C=C2)O)O)CN)CO

InChI

InChI=1S/C11H15NO4/c12-4-10-7-1-2-9(14)11(15)8(7)3-6(5-13)16-10/h1-2,6,10,13-15H,3-5,12H2/t6-,10-/m1/s1