3-(3-bromanylpropyl)-1,2-dinitro-cyclohexa-1,3-diene

Systemtic Name: 3-(3-bromanylpropyl)-1,2-dinitro-cyclohexa-1,3-diene Openeye Name: 3-(3-bromopropyl)-1,2-dinitro-cyclohexa-1,3-diene CAS Name: 3-(3-bromopropyl)-1,2-dinitrocyclohexa-1,3-diene IUPAC Name: 3-(3-bromopropyl)-1,2-dinitrocyclohexa-1,3-diene Traditional Name: 3-(3-bromopropyl)-1,2-dinitro-cyclohexa-1,3-diene Formula: C9H11BrN2O4 MolecularWeight: 291.09864

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(C(=C1)CCCBr)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CC(=C(C(=C1)CCCBr)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H11BrN2O4/c10-6-2-4-7-3-1-5-8(11(13)14)9(7)12(15)16/h3H,1-2,4-6H2