[3-(trifluoromethyl)phenyl]methyl 2-(2-hydroxyethylamino)-5-nitro-benzoate

Systemtic Name: [3-(trifluoromethyl)phenyl]methyl 2-(2-hydroxyethylamino)-5-nitro-benzoate Openeye Name: [3-(trifluoromethyl)phenyl]methyl 2-(2-hydroxyethylamino)-5-nitro-benzoate CAS Name: 2-(2-hydroxyethylamino)-5-nitrobenzoic acid [3-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [3-(trifluoromethyl)phenyl]methyl 2-(2-hydroxyethylamino)-5-nitrobenzoate Traditional Name: 2-(2-hydroxyethylamino)-5-nitro-benzoic acid [3-(trifluoromethyl)benzyl] ester Formula: C17H15F3N2O5 MolecularWeight: 384.30661

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15F3N2O5/c18-17(19,20)12-3-1-2-11(8-12)10-27-16(24)14-9-13(22(25)26)4-5-15(14)21-6-7-23/h1-5,8-9,21,23H,6-7,10H2