pyridin-2-ylmethyl 5-chloranyl-2-nitro-benzoate

Systemtic Name: pyridin-2-ylmethyl 5-chloranyl-2-nitro-benzoate Openeye Name: 2-pyridylmethyl 5-chloro-2-nitro-benzoate CAS Name: 5-chloro-2-nitrobenzoic acid 2-pyridinylmethyl ester IUPAC Name: pyridin-2-ylmethyl 5-chloro-2-nitrobenzoate Traditional Name: 5-chloro-2-nitro-benzoic acid 2-pyridylmethyl ester Formula: C13H9ClN2O4 MolecularWeight: 292.67456

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H9ClN2O4/c14-9-4-5-12(16(18)19)11(7-9)13(17)20-8-10-3-1-2-6-15-10/h1-7H,8H2