4-chloranyl-5,7-dinitro-2-(2,4,6-trinitrophenyl)-2H-quinazolin-1-ium 1-oxide

Systemtic Name: 4-chloranyl-5,7-dinitro-2-(2,4,6-trinitrophenyl)-2H-quinazolin-1-ium 1-oxide Openeye Name: 4-chloro-5,7-dinitro-2-(2,4,6-trinitrophenyl)-2H-quinazolin-1-ium 1-oxide CAS Name: 4-chloro-5,7-dinitro-2-(2,4,6-trinitrophenyl)-2H-quinazolin-1-ium 1-oxide IUPAC Name: 4-chloro-5,7-dinitro-2-(2,4,6-trinitrophenyl)-2H-quinazolin-1-ium 1-oxide Traditional Name: 4-chloro-5,7-dinitro-2-picryl-2H-quinazolin-1-ium 1-oxide Formula: C14H5ClN7O11+ MolecularWeight: 482.6828

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C2C(=C1[N+](=O)[O-])C(=NC([N+]2=O)C3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])Cl)[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C2C(=C1[N+](=O)[O-])C(=NC([N+]2=O)C3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H5ClN7O11/c15-13-11-7(1-5(18(24)25)2-8(11)20(28)29)17(23)14(16-13)12-9(21(30)31)3-6(19(26)27)4-10(12)22(32)33/h1-4,14H/q+1