5-nitrocyclohexa-2,4-diene-1,1-diamine

Systemtic Name: 5-nitrocyclohexa-2,4-diene-1,1-diamine Openeye Name: 5-nitrocyclohexa-2,4-diene-1,1-diamine CAS Name: 5-nitrocyclohexa-2,4-diene-1,1-diamine IUPAC Name: 5-nitrocyclohexa-2,4-diene-1,1-diamine Traditional Name: (1-amino-5-nitro-cyclohexa-2,4-dien-1-yl)amine Formula: C6H9N3O2 MolecularWeight: 155.15456

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC=CC1(N)N)[N+](=O)[O-]

Isomeric SMILES

C1C(=CC=CC1(N)N)[N+](=O)[O-]

InChI

InChI=1S/C6H9N3O2/c7-6(8)3-1-2-5(4-6)9(10)11/h1-3H,4,7-8H2