5-chloranylpyrimidine-2,4,6-triamine; 2,4,6-trinitrophenol

Systemtic Name: 5-chloranylpyrimidine-2,4,6-triamine; 2,4,6-trinitrophenol Openeye Name: 5-chloropyrimidine-2,4,6-triamine; picric acid CAS Name: 5-chloropyrimidine-2,4,6-triamine; 2,4,6-trinitrophenol IUPAC Name: 5-chloropyrimidine-2,4,6-triamine; 2,4,6-trinitrophenol Traditional Name: (2,6-diamino-5-chloro-pyrimidin-4-yl)amine; picric acid Formula: C10H9ClN8O7 MolecularWeight: 388.68086

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-].C1(=C(N=C(N=C1N)N)N)Cl

Isomeric SMILES

C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-].C1(=C(N=C(N=C1N)N)N)Cl

InChI

InChI=1S/C6H3N3O7.C4H6ClN5/c10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16;5-1-2(6)9-4(8)10-3(1)7/h1-2,10H;(H6,6,7,8,9,10)