methyl 3-[(2-chloranyl-5-nitro-phenyl)carbonylamino]pyrazine-2-carboxylate

Systemtic Name: methyl 3-[(2-chloranyl-5-nitro-phenyl)carbonylamino]pyrazine-2-carboxylate Openeye Name: methyl 3-[(2-chloro-5-nitro-benzoyl)amino]pyrazine-2-carboxylate CAS Name: 3-[[(2-chloro-5-nitrophenyl)-oxomethyl]amino]-2-pyrazinecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2-chloro-5-nitrobenzoyl)amino]pyrazine-2-carboxylate Traditional Name: 3-[(2-chloro-5-nitro-benzoyl)amino]pyrazinic acid methyl ester Formula: C13H9ClN4O5 MolecularWeight: 336.68736

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC=CN=C1NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

COC(=O)C1=NC=CN=C1NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H9ClN4O5/c1-23-13(20)10-11(16-5-4-15-10)17-12(19)8-6-7(18(21)22)2-3-9(8)14/h2-6H,1H3,(H,16,17,19)