methyl 3-azanyl-4-chloranyl-5-nitro-benzoate

Systemtic Name: methyl 3-azanyl-4-chloranyl-5-nitro-benzoate Openeye Name: methyl 3-amino-4-chloro-5-nitro-benzoate CAS Name: 3-amino-4-chloro-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-amino-4-chloro-5-nitrobenzoate Traditional Name: 3-amino-4-chloro-5-nitro-benzoic acid methyl ester Formula: C8H7ClN2O4 MolecularWeight: 230.60518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H7ClN2O4/c1-15-8(12)4-2-5(10)7(9)6(3-4)11(13)14/h2-3H,10H2,1H3