5-(4-chloranyl-3-nitro-phenyl)-1,2,4-triazin-3-amine

Systemtic Name: 5-(4-chloranyl-3-nitro-phenyl)-1,2,4-triazin-3-amine Openeye Name: 5-(4-chloro-3-nitro-phenyl)-1,2,4-triazin-3-amine CAS Name: 5-(4-chloro-3-nitrophenyl)-1,2,4-triazin-3-amine IUPAC Name: 5-(4-chloro-3-nitrophenyl)-1,2,4-triazin-3-amine Traditional Name: [5-(4-chloro-3-nitro-phenyl)-1,2,4-triazin-3-yl]amine Formula: C9H6ClN5O2 MolecularWeight: 251.62924

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C2=CN=NC(=N2)N)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1C2=CN=NC(=N2)N)[N+](=O)[O-])Cl

InChI

InChI=1S/C9H6ClN5O2/c10-6-2-1-5(3-8(6)15(16)17)7-4-12-14-9(11)13-7/h1-4H,(H2,11,13,14)