5-[[4-[2-azanyl-4-(trifluoromethyl)phenoxy]-3-methoxy-phenyl]methylamino]-2-morpholin-4-yl-benzoate

Systemtic Name: 5-[[4-[2-azanyl-4-(trifluoromethyl)phenoxy]-3-methoxy-phenyl]methylamino]-2-morpholin-4-yl-benzoate Openeye Name: 5-[[4-[2-amino-4-(trifluoromethyl)phenoxy]-3-methoxy-phenyl]methylamino]-2-morpholino-benzoate CAS Name: 5-[[4-[2-amino-4-(trifluoromethyl)phenoxy]-3-methoxyphenyl]methylamino]-2-(4-morpholinyl)benzoate IUPAC Name: 5-[[4-[2-amino-4-(trifluoromethyl)phenoxy]-3-methoxyphenyl]methylamino]-2-morpholin-4-ylbenzoate Traditional Name: 5-[[4-[2-amino-4-(trifluoromethyl)phenoxy]-3-methoxy-benzyl]amino]-2-morpholino-benzoate Formula: C26H25F3N3O5- MolecularWeight: 516.48901

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC2=CC(=C(C=C2)N3CCOCC3)C(=O)[O-])OC4=C(C=C(C=C4)C(F)(F)F)N

Isomeric SMILES

COC1=C(C=CC(=C1)CNC2=CC(=C(C=C2)N3CCOCC3)C(=O)[O-])OC4=C(C=C(C=C4)C(F)(F)F)N

InChI

InChI=1S/C26H26F3N3O5/c1-35-24-12-16(2-6-23(24)37-22-7-3-17(13-20(22)30)26(27,28)29)15-31-18-4-5-21(19(14-18)25(33)34)32-8-10-36-11-9-32/h2-7,12-14,31H,8-11,15,30H2,1H3,(H,33,34)/p-1