1,3-dinitrobenzene; pyridin-1-ium; hydrochloride

Systemtic Name: 1,3-dinitrobenzene; pyridin-1-ium; hydrochloride Openeye Name: 1,3-dinitrobenzene; pyridin-1-ium; hydrochloride CAS Name: 1,3-dinitrobenzene; pyridin-1-ium; hydrochloride IUPAC Name: 1,3-dinitrobenzene; pyridin-1-ium; hydrochloride Traditional Name: 1,3-dinitrobenzene; pyridin-1-ium; hydrochloride Formula: C11H11ClN3O4+ MolecularWeight: 284.67574

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[NH+]C=C1.C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-].Cl

Isomeric SMILES

C1=CC=[NH+]C=C1.C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-].Cl

InChI

InChI=1S/C6H4N2O4.C5H5N.ClH/c9-7(10)5-2-1-3-6(4-5)8(11)12;1-2-4-6-5-3-1;/h1-4H;1-5H;1H/p+1