(5-chloranyl-2-methoxy-phenyl)methyl 2-(2-hydroxyethylamino)-5-nitro-benzoate

Systemtic Name: (5-chloranyl-2-methoxy-phenyl)methyl 2-(2-hydroxyethylamino)-5-nitro-benzoate Openeye Name: (5-chloro-2-methoxy-phenyl)methyl 2-(2-hydroxyethylamino)-5-nitro-benzoate CAS Name: 2-(2-hydroxyethylamino)-5-nitrobenzoic acid (5-chloro-2-methoxyphenyl)methyl ester IUPAC Name: (5-chloro-2-methoxyphenyl)methyl 2-(2-hydroxyethylamino)-5-nitrobenzoate Traditional Name: 2-(2-hydroxyethylamino)-5-nitro-benzoic acid (5-chloro-2-methoxy-benzyl) ester Formula: C17H17ClN2O6 MolecularWeight: 380.77968

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCCO

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCCO

InChI

InChI=1S/C17H17ClN2O6/c1-25-16-5-2-12(18)8-11(16)10-26-17(22)14-9-13(20(23)24)3-4-15(14)19-6-7-21/h2-5,8-9,19,21H,6-7,10H2,1H3