4-[(3-methoxy-4-phenylmethoxy-phenyl)methylamino]benzoic acid

Systemtic Name: 4-[(3-methoxy-4-phenylmethoxy-phenyl)methylamino]benzoic acid Openeye Name: 4-[(4-benzyloxy-3-methoxy-phenyl)methylamino]benzoic acid CAS Name: 4-[(3-methoxy-4-phenylmethoxyphenyl)methylamino]benzoic acid IUPAC Name: 4-[(3-methoxy-4-phenylmethoxyphenyl)methylamino]benzoic acid Traditional Name: 4-[(4-benzoxy-3-methoxy-benzyl)amino]benzoic acid Formula: C22H21NO4 MolecularWeight: 363.40644

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC2=CC=C(C=C2)C(=O)O)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)CNC2=CC=C(C=C2)C(=O)O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H21NO4/c1-26-21-13-17(14-23-19-10-8-18(9-11-19)22(24)25)7-12-20(21)27-15-16-5-3-2-4-6-16/h2-13,23H,14-15H2,1H3,(H,24,25)