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

Systemtic Name: 5-[[2-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]methylamino]-2-morpholin-4-yl-benzoic acid Openeye Name: 5-[[2-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]methylamino]-2-morpholino-benzoic acid CAS Name: 5-[[2-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]methylamino]-2-(4-morpholinyl)benzoic acid IUPAC Name: 5-[[2-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]methylamino]-2-morpholin-4-ylbenzoic acid Traditional Name: 5-[[2-(4-chlorobenzyl)oxy-3-methoxy-benzyl]amino]-2-morpholino-benzoic acid Formula: C26H27ClN2O5 MolecularWeight: 482.95598

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OCC2=CC=C(C=C2)Cl)CNC3=CC(=C(C=C3)N4CCOCC4)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1OCC2=CC=C(C=C2)Cl)CNC3=CC(=C(C=C3)N4CCOCC4)C(=O)O

InChI

InChI=1S/C26H27ClN2O5/c1-32-24-4-2-3-19(25(24)34-17-18-5-7-20(27)8-6-18)16-28-21-9-10-23(22(15-21)26(30)31)29-11-13-33-14-12-29/h2-10,15,28H,11-14,16-17H2,1H3,(H,30,31)