methyl 5-chloranyl-4-(methylamino)-3-nitro-2-oxidanyl-benzoate

Systemtic Name: methyl 5-chloranyl-4-(methylamino)-3-nitro-2-oxidanyl-benzoate Openeye Name: methyl 5-chloro-2-hydroxy-4-(methylamino)-3-nitro-benzoate CAS Name: 5-chloro-2-hydroxy-4-(methylamino)-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 5-chloro-2-hydroxy-4-(methylamino)-3-nitrobenzoate Traditional Name: 5-chloro-2-hydroxy-4-(methylamino)-3-nitro-benzoic acid methyl ester Formula: C9H9ClN2O5 MolecularWeight: 260.63116

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C(=C1[N+](=O)[O-])O)C(=O)OC)Cl

Isomeric SMILES

CNC1=C(C=C(C(=C1[N+](=O)[O-])O)C(=O)OC)Cl

InChI

InChI=1S/C9H9ClN2O5/c1-11-6-5(10)3-4(9(14)17-2)8(13)7(6)12(15)16/h3,11,13H,1-2H3