methyl 2-azanyl-5-chloranyl-3-nitro-6-oxidanyl-benzoate

Systemtic Name: methyl 2-azanyl-5-chloranyl-3-nitro-6-oxidanyl-benzoate Openeye Name: methyl 2-amino-5-chloro-6-hydroxy-3-nitro-benzoate CAS Name: 2-amino-5-chloro-6-hydroxy-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-amino-5-chloro-6-hydroxy-3-nitrobenzoate Traditional Name: 2-amino-5-chloro-6-hydroxy-3-nitro-benzoic acid methyl ester Formula: C8H7ClN2O5 MolecularWeight: 246.60458

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=CC(=C1O)Cl)[N+](=O)[O-])N

Isomeric SMILES

COC(=O)C1=C(C(=CC(=C1O)Cl)[N+](=O)[O-])N

InChI

InChI=1S/C8H7ClN2O5/c1-16-8(13)5-6(10)4(11(14)15)2-3(9)7(5)12/h2,12H,10H2,1H3