5-[[4-[(4-fluorophenyl)methoxy]-3-methoxy-phenyl]methylamino]-2-morpholin-4-yl-benzoic acid

Systemtic Name: 5-[[4-[(4-fluorophenyl)methoxy]-3-methoxy-phenyl]methylamino]-2-morpholin-4-yl-benzoic acid Openeye Name: 5-[[4-[(4-fluorophenyl)methoxy]-3-methoxy-phenyl]methylamino]-2-morpholino-benzoic acid CAS Name: 5-[[4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl]methylamino]-2-(4-morpholinyl)benzoic acid IUPAC Name: 5-[[4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl]methylamino]-2-morpholin-4-ylbenzoic acid Traditional Name: 5-[[4-(4-fluorobenzyl)oxy-3-methoxy-benzyl]amino]-2-morpholino-benzoic acid Formula: C26H27FN2O5 MolecularWeight: 466.501383

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC2=CC(=C(C=C2)N3CCOCC3)C(=O)O)OCC4=CC=C(C=C4)F

Isomeric SMILES

COC1=C(C=CC(=C1)CNC2=CC(=C(C=C2)N3CCOCC3)C(=O)O)OCC4=CC=C(C=C4)F

InChI

InChI=1S/C26H27FN2O5/c1-32-25-14-19(4-9-24(25)34-17-18-2-5-20(27)6-3-18)16-28-21-7-8-23(22(15-21)26(30)31)29-10-12-33-13-11-29/h2-9,14-15,28H,10-13,16-17H2,1H3,(H,30,31)