4-imidazol-1-yl-3-nitro-benzoic acid hydrochloride

Systemtic Name: 4-imidazol-1-yl-3-nitro-benzoic acid hydrochloride Openeye Name: 4-imidazol-1-yl-3-nitro-benzoic acid hydrochloride CAS Name: 4-(1-imidazolyl)-3-nitrobenzoic acid hydrochloride IUPAC Name: 4-imidazol-1-yl-3-nitrobenzoic acid hydrochloride Traditional Name: 4-imidazol-1-yl-3-nitro-benzoic acid hydrochloride Formula: C10H8ClN3O4 MolecularWeight: 269.64122

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])N2C=CN=C2.Cl

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])N2C=CN=C2.Cl

InChI

InChI=1S/C10H7N3O4.ClH/c14-10(15)7-1-2-8(9(5-7)13(16)17)12-4-3-11-6-12;/h1-6H,(H,14,15);1H