3-[[5-[2,3-bis(oxidanyl)propoxy]-2-nitro-phenyl]amino]propane-1,2-diol

Systemtic Name: 3-[[5-[2,3-bis(oxidanyl)propoxy]-2-nitro-phenyl]amino]propane-1,2-diol Openeye Name: 3-[5-(2,3-dihydroxypropoxy)-2-nitro-anilino]propane-1,2-diol CAS Name: 3-[5-(2,3-dihydroxypropoxy)-2-nitroanilino]propane-1,2-diol IUPAC Name: 3-[5-(2,3-dihydroxypropoxy)-2-nitroanilino]propane-1,2-diol Traditional Name: 3-(5-glyceryloxy-2-nitro-anilino)propane-1,2-diol Formula: C12H18N2O7 MolecularWeight: 302.28052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1OCC(CO)O)NCC(CO)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1OCC(CO)O)NCC(CO)O)[N+](=O)[O-]

InChI

InChI=1S/C12H18N2O7/c15-5-8(17)4-13-11-3-10(21-7-9(18)6-16)1-2-12(11)14(19)20/h1-3,8-9,13,15-18H,4-7H2