methyl 5-azanyl-2-[bis[3-(trifluoromethyl)phenyl]methoxy]benzoate

Systemtic Name: methyl 5-azanyl-2-[bis[3-(trifluoromethyl)phenyl]methoxy]benzoate Openeye Name: methyl 5-amino-2-[bis[3-(trifluoromethyl)phenyl]methoxy]benzoate CAS Name: 5-amino-2-[bis[3-(trifluoromethyl)phenyl]methoxy]benzoic acid methyl ester IUPAC Name: methyl 5-amino-2-[bis[3-(trifluoromethyl)phenyl]methoxy]benzoate Traditional Name: 5-amino-2-[bis[3-(trifluoromethyl)phenyl]methoxy]benzoic acid methyl ester Formula: C23H17F6NO3 MolecularWeight: 469.376399

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)N)OC(C2=CC(=CC=C2)C(F)(F)F)C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)N)OC(C2=CC(=CC=C2)C(F)(F)F)C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C23H17F6NO3/c1-32-21(31)18-12-17(30)8-9-19(18)33-20(13-4-2-6-15(10-13)22(24,25)26)14-5-3-7-16(11-14)23(27,28)29/h2-12,20H,30H2,1H3