(6-methylpyridin-3-yl) 2-nitrobenzoate

Systemtic Name: (6-methylpyridin-3-yl) 2-nitrobenzoate Openeye Name: (6-methyl-3-pyridyl) 2-nitrobenzoate CAS Name: 2-nitrobenzoic acid (6-methyl-3-pyridinyl) ester IUPAC Name: (6-methylpyridin-3-yl) 2-nitrobenzoate Traditional Name: 2-nitrobenzoic acid (6-methyl-3-pyridyl) ester Formula: C13H10N2O4 MolecularWeight: 258.2295

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)OC(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(C=C1)OC(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C13H10N2O4/c1-9-6-7-10(8-14-9)19-13(16)11-4-2-3-5-12(11)15(17)18/h2-8H,1H3