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

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

CC(C(NC1=CC(=C(C=C1Cl)N)[N+](=O)[O-])O)O

Isomeric SMILES

CC(C(NC1=CC(=C(C=C1Cl)N)[N+](=O)[O-])O)O

InChI

InChI=1S/C9H12ClN3O4/c1-4(14)9(15)12-7-3-8(13(16)17)6(11)2-5(7)10/h2-4,9,12,14-15H,11H2,1H3