4-(4-aminophenyl)-6,6-dinitro-cyclohexa-1,3-dien-1-amine

Systemtic Name: 4-(4-aminophenyl)-6,6-dinitro-cyclohexa-1,3-dien-1-amine Openeye Name: 4-(4-aminophenyl)-6,6-dinitro-cyclohexa-1,3-dien-1-amine CAS Name: 4-(4-aminophenyl)-6,6-dinitro-1-cyclohexa-1,3-dienamine IUPAC Name: 4-(4-aminophenyl)-6,6-dinitrocyclohexa-1,3-dien-1-amine Traditional Name: [4-(4-amino-5,5-dinitro-cyclohexa-1,3-dien-1-yl)phenyl]amine Formula: C12H12N4O4 MolecularWeight: 276.24808

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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