N-(2-chloranyl-4-nitro-phenyl)-4-(3-nitro-1,2,4-triazol-1-yl)butanamide

Systemtic Name: N-(2-chloranyl-4-nitro-phenyl)-4-(3-nitro-1,2,4-triazol-1-yl)butanamide Openeye Name: N-(2-chloro-4-nitro-phenyl)-4-(3-nitro-1,2,4-triazol-1-yl)butanamide CAS Name: N-(2-chloro-4-nitrophenyl)-4-(3-nitro-1,2,4-triazol-1-yl)butanamide IUPAC Name: N-(2-chloro-4-nitrophenyl)-4-(3-nitro-1,2,4-triazol-1-yl)butanamide Traditional Name: N-(2-chloro-4-nitro-phenyl)-4-(3-nitro-1,2,4-triazol-1-yl)butyramide Formula: C12H11ClN6O5 MolecularWeight: 354.70594

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])Cl)NC(=O)CCCN2C=NC(=N2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])Cl)NC(=O)CCCN2C=NC(=N2)[N+](=O)[O-]

InChI

InChI=1S/C12H11ClN6O5/c13-9-6-8(18(21)22)3-4-10(9)15-11(20)2-1-5-17-7-14-12(16-17)19(23)24/h3-4,6-7H,1-2,5H2,(H,15,20)