1,3,5-trinitro-2-[(2,4,6-trinitrophenyl)methyl]benzene

Systemtic Name: 1,3,5-trinitro-2-[(2,4,6-trinitrophenyl)methyl]benzene Openeye Name: 1,3,5-trinitro-2-[(2,4,6-trinitrophenyl)methyl]benzene CAS Name: 1,3,5-trinitro-2-[(2,4,6-trinitrophenyl)methyl]benzene IUPAC Name: 1,3,5-trinitro-2-[(2,4,6-trinitrophenyl)methyl]benzene Traditional Name: 1,3,5-trinitro-2-(2,4,6-trinitrobenzyl)benzene Formula: C13H6N6O12 MolecularWeight: 438.21974

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1[N+](=O)[O-])CC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C(C(=C1[N+](=O)[O-])CC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H6N6O12/c20-14(21)6-1-10(16(24)25)8(11(2-6)17(26)27)5-9-12(18(28)29)3-7(15(22)23)4-13(9)19(30)31/h1-4H,5H2