3-[3,6-bis(azanyl)-2-nitro-phenyl]propane-1,2-diol

Systemtic Name: 3-[3,6-bis(azanyl)-2-nitro-phenyl]propane-1,2-diol Openeye Name: 3-(3,6-diamino-2-nitro-phenyl)propane-1,2-diol CAS Name: 3-(3,6-diamino-2-nitrophenyl)propane-1,2-diol IUPAC Name: 3-(3,6-diamino-2-nitrophenyl)propane-1,2-diol Traditional Name: 3-(3,6-diamino-2-nitro-phenyl)propane-1,2-diol Formula: C9H13N3O4 MolecularWeight: 227.21722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1N)CC(CO)O)[N+](=O)[O-])N

Isomeric SMILES

C1=CC(=C(C(=C1N)CC(CO)O)[N+](=O)[O-])N

InChI

InChI=1S/C9H13N3O4/c10-7-1-2-8(11)9(12(15)16)6(7)3-5(14)4-13/h1-2,5,13-14H,3-4,10-11H2