3-[(4-azanyl-2-chloranyl-5-nitro-phenyl)amino]propane-1,2-diol

Systemtic Name: 3-[(4-azanyl-2-chloranyl-5-nitro-phenyl)amino]propane-1,2-diol Openeye Name: 3-(4-amino-2-chloro-5-nitro-anilino)propane-1,2-diol CAS Name: 3-(4-amino-2-chloro-5-nitroanilino)propane-1,2-diol IUPAC Name: 3-(4-amino-2-chloro-5-nitroanilino)propane-1,2-diol Traditional Name: 3-(4-amino-2-chloro-5-nitro-anilino)propane-1,2-diol Formula: C9H12ClN3O4 MolecularWeight: 261.66228

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H12ClN3O4/c10-6-1-7(11)9(13(16)17)2-8(6)12-3-5(15)4-14/h1-2,5,12,14-15H,3-4,11H2