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

Systemtic Name: 3-[[3-[2,3-bis(oxidanyl)propylamino]-2-nitro-phenyl]amino]propane-1,2-diol Openeye Name: 3-[3-(2,3-dihydroxypropylamino)-2-nitro-anilino]propane-1,2-diol CAS Name: 3-[3-(2,3-dihydroxypropylamino)-2-nitroanilino]propane-1,2-diol IUPAC Name: 3-[3-(2,3-dihydroxypropylamino)-2-nitroanilino]propane-1,2-diol Traditional Name: 3-[3-(glycerylamino)-2-nitro-anilino]propane-1,2-diol Formula: C12H19N3O6 MolecularWeight: 301.29576

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19N3O6/c16-6-8(18)4-13-10-2-1-3-11(12(10)15(20)21)14-5-9(19)7-17/h1-3,8-9,13-14,16-19H,4-7H2