(6-methylpyridin-3-yl) 2-chloranyl-4-nitro-benzoate

Systemtic Name: (6-methylpyridin-3-yl) 2-chloranyl-4-nitro-benzoate Openeye Name: (6-methyl-3-pyridyl) 2-chloro-4-nitro-benzoate CAS Name: 2-chloro-4-nitrobenzoic acid (6-methyl-3-pyridinyl) ester IUPAC Name: (6-methylpyridin-3-yl) 2-chloro-4-nitrobenzoate Traditional Name: 2-chloro-4-nitro-benzoic acid (6-methyl-3-pyridyl) ester Formula: C13H9ClN2O4 MolecularWeight: 292.67456

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H9ClN2O4/c1-8-2-4-10(7-15-8)20-13(17)11-5-3-9(16(18)19)6-12(11)14/h2-7H,1H3