4-(4-azanyl-3,3-dinitro-cyclohexa-1,4-dien-1-yl)-2,6-dinitro-aniline

Systemtic Name: 4-(4-azanyl-3,3-dinitro-cyclohexa-1,4-dien-1-yl)-2,6-dinitro-aniline Openeye Name: 4-(4-amino-3,3-dinitro-cyclohexa-1,4-dien-1-yl)-2,6-dinitro-aniline CAS Name: 4-(4-amino-3,3-dinitro-1-cyclohexa-1,4-dienyl)-2,6-dinitroaniline IUPAC Name: 4-(4-amino-3,3-dinitrocyclohexa-1,4-dien-1-yl)-2,6-dinitroaniline Traditional Name: [4-(4-amino-3,3-dinitro-cyclohexa-1,4-dien-1-yl)-2,6-dinitro-phenyl]amine Formula: C12H10N6O8 MolecularWeight: 366.2432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C=C(C(C=C1C2=CC(=C(C(=C2)[N+](=O)[O-])N)[N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])N

Isomeric SMILES

C1C=C(C(C=C1C2=CC(=C(C(=C2)[N+](=O)[O-])N)[N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])N

InChI

InChI=1S/C12H10N6O8/c13-10-2-1-6(5-12(10,17(23)24)18(25)26)7-3-8(15(19)20)11(14)9(4-7)16(21)22/h2-5H,1,13-14H2