1,3,5-trinitro-2,4-diphenyl-cyclohexa-1,3-diene

Systemtic Name: 1,3,5-trinitro-2,4-diphenyl-cyclohexa-1,3-diene Openeye Name: 1,3,5-trinitro-2,4-diphenyl-cyclohexa-1,3-diene CAS Name: 1,3,5-trinitro-2,4-diphenylcyclohexa-1,3-diene IUPAC Name: 1,3,5-trinitro-2,4-diphenylcyclohexa-1,3-diene Traditional Name: 1,3,5-trinitro-2,4-diphenyl-cyclohexa-1,3-diene Formula: C18H13N3O6 MolecularWeight: 367.31232

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=C(C(=C1[N+](=O)[O-])C2=CC=CC=C2)[N+](=O)[O-])C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1C(C(=C(C(=C1[N+](=O)[O-])C2=CC=CC=C2)[N+](=O)[O-])C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H13N3O6/c22-19(23)14-11-15(20(24)25)17(13-9-5-2-6-10-13)18(21(26)27)16(14)12-7-3-1-4-8-12/h1-10,14H,11H2