6,6-dinitro-3-phenyl-cyclohexa-2,4-diene-1,1-diamine

Systemtic Name: 6,6-dinitro-3-phenyl-cyclohexa-2,4-diene-1,1-diamine Openeye Name: 6,6-dinitro-3-phenyl-cyclohexa-2,4-diene-1,1-diamine CAS Name: 6,6-dinitro-3-phenylcyclohexa-2,4-diene-1,1-diamine IUPAC Name: 6,6-dinitro-3-phenylcyclohexa-2,4-diene-1,1-diamine Traditional Name: (1-amino-6,6-dinitro-3-phenyl-cyclohexa-2,4-dien-1-yl)amine Formula: C12H12N4O4 MolecularWeight: 276.24808

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N4O4/c13-11(14)8-10(9-4-2-1-3-5-9)6-7-12(11,15(17)18)16(19)20/h1-8H,13-14H2