1-(3-nitropyridin-2-yl)-1,4-diazepane hydrochloride

Systemtic Name: 1-(3-nitropyridin-2-yl)-1,4-diazepane hydrochloride Openeye Name: 1-(3-nitro-2-pyridyl)-1,4-diazepane hydrochloride CAS Name: 1-(3-nitro-2-pyridinyl)-1,4-diazepane hydrochloride IUPAC Name: 1-(3-nitropyridin-2-yl)-1,4-diazepane hydrochloride Traditional Name: 1-(3-nitro-2-pyridyl)-1,4-diazepane hydrochloride Formula: C10H15ClN4O2 MolecularWeight: 258.7047

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C2=C(C=CC=N2)[N+](=O)[O-].Cl

Isomeric SMILES

C1CNCCN(C1)C2=C(C=CC=N2)[N+](=O)[O-].Cl

InChI

InChI=1S/C10H14N4O2.ClH/c15-14(16)9-3-1-5-12-10(9)13-7-2-4-11-6-8-13;/h1,3,5,11H,2,4,6-8H2;1H