4-azanyl-N-[(2R)-2-[(2-chloranyl-4-nitro-phenyl)amino]propyl]-1,2,5-oxadiazole-3-carboxamide

Systemtic Name: 4-azanyl-N-[(2R)-2-[(2-chloranyl-4-nitro-phenyl)amino]propyl]-1,2,5-oxadiazole-3-carboxamide Openeye Name: 4-amino-N-[(2R)-2-(2-chloro-4-nitro-anilino)propyl]-1,2,5-oxadiazole-3-carboxamide CAS Name: 4-amino-N-[(2R)-2-(2-chloro-4-nitroanilino)propyl]-1,2,5-oxadiazole-3-carboxamide IUPAC Name: 4-amino-N-[(2R)-2-(2-chloro-4-nitroanilino)propyl]-1,2,5-oxadiazole-3-carboxamide Traditional Name: 4-amino-N-[(2R)-2-(2-chloro-4-nitro-anilino)propyl]furazan-3-carboxamide Formula: C12H13ClN6O4 MolecularWeight: 340.72242

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1=NON=C1N)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C[C@H](CNC(=O)C1=NON=C1N)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H13ClN6O4/c1-6(5-15-12(20)10-11(14)18-23-17-10)16-9-3-2-7(19(21)22)4-8(9)13/h2-4,6,16H,5H2,1H3,(H2,14,18)(H,15,20)/t6-/m1/s1