4-(3-nitropyridin-2-yl)benzoate

Systemtic Name: 4-(3-nitropyridin-2-yl)benzoate Openeye Name: 4-(3-nitro-2-pyridyl)benzoate CAS Name: 4-(3-nitro-2-pyridinyl)benzoate IUPAC Name: 4-(3-nitropyridin-2-yl)benzoate Traditional Name: 4-(3-nitro-2-pyridyl)benzoate Formula: C12H7N2O4- MolecularWeight: 243.19498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)C2=CC=C(C=C2)C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(N=C1)C2=CC=C(C=C2)C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H8N2O4/c15-12(16)9-5-3-8(4-6-9)11-10(14(17)18)2-1-7-13-11/h1-7H,(H,15,16)/p-1