2-(4-azanyl-2-methyl-phenyl)propane-1,3-diol sulfite

Systemtic Name: 2-(4-azanyl-2-methyl-phenyl)propane-1,3-diol sulfite Openeye Name: 2-(4-amino-2-methyl-phenyl)propane-1,3-diol sulfite CAS Name: 2-(4-amino-2-methylphenyl)propane-1,3-diol sulfite IUPAC Name: 2-(4-amino-2-methylphenyl)propane-1,3-diol sulfite Traditional Name: 2-(4-amino-2-methyl-phenyl)propane-1,3-diol sulfite Formula: C10H15NO5S-2 MolecularWeight: 261.2948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N)C(CO)CO.[O-]S(=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)N)C(CO)CO.[O-]S(=O)[O-]

InChI

InChI=1S/C10H15NO2.H2O3S/c1-7-4-9(11)2-3-10(7)8(5-12)6-13;1-4(2)3/h2-4,8,12-13H,5-6,11H2,1H3;(H2,1,2,3)/p-2