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2-(2-azanylethylamino)-3,5-dinitro-benzoic acid hydrochloride

2-(2-azanylethylamino)-3,5-dinitro-benzoic acid hydrochloride

Systemtic Name:2-(2-azanylethylamino)-3,5-dinitro-benzoic acid hydrochloride
Openeye Name:2-(2-aminoethylamino)-3,5-dinitro-benzoic acid hydrochloride
CAS Name:2-(2-aminoethylamino)-3,5-dinitrobenzoic acid hydrochloride
IUPAC Name:2-(2-aminoethylamino)-3,5-dinitrobenzoic acid hydrochloride
Traditional Name:2-(2-aminoethylamino)-3,5-dinitro-benzoic acid hydrochloride
Formula: C9H11ClN4O6
MolecularWeight: 306.65984
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C9H10N4O6.ClH/c10-1-2-11-8-6(9(14)15)3-5(12(16)17)4-7(8)13(18)19;/h3-4,11H,1-2,10H2,(H,14,15);1H


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