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

Systemtic Name: 5-[[3-methoxy-4-[(3-methylphenyl)methoxy]phenyl]methylamino]-2-morpholin-4-yl-benzoic acid Openeye Name: 5-[[3-methoxy-4-(m-tolylmethoxy)phenyl]methylamino]-2-morpholino-benzoic acid CAS Name: 5-[[3-methoxy-4-[(3-methylphenyl)methoxy]phenyl]methylamino]-2-(4-morpholinyl)benzoic acid IUPAC Name: 5-[[3-methoxy-4-[(3-methylphenyl)methoxy]phenyl]methylamino]-2-morpholin-4-ylbenzoic acid Traditional Name: 5-[[3-methoxy-4-(3-methylbenzyl)oxy-benzyl]amino]-2-morpholino-benzoic acid Formula: C27H30N2O5 MolecularWeight: 462.5375

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)COC2=C(C=C(C=C2)CNC3=CC(=C(C=C3)N4CCOCC4)C(=O)O)OC

Isomeric SMILES

CC1=CC(=CC=C1)COC2=C(C=C(C=C2)CNC3=CC(=C(C=C3)N4CCOCC4)C(=O)O)OC

InChI

InChI=1S/C27H30N2O5/c1-19-4-3-5-21(14-19)18-34-25-9-6-20(15-26(25)32-2)17-28-22-7-8-24(23(16-22)27(30)31)29-10-12-33-13-11-29/h3-9,14-16,28H,10-13,17-18H2,1-2H3,(H,30,31)