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

Systemtic Name: 5-[(2-ethoxy-3-methoxy-phenyl)methylamino]-2-morpholin-4-yl-benzoic acid Openeye Name: 5-[(2-ethoxy-3-methoxy-phenyl)methylamino]-2-morpholino-benzoic acid CAS Name: 5-[(2-ethoxy-3-methoxyphenyl)methylamino]-2-(4-morpholinyl)benzoic acid IUPAC Name: 5-[(2-ethoxy-3-methoxyphenyl)methylamino]-2-morpholin-4-ylbenzoic acid Traditional Name: 5-[(2-ethoxy-3-methoxy-benzyl)amino]-2-morpholino-benzoic acid Formula: C21H26N2O5 MolecularWeight: 386.44154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC=C1OC)CNC2=CC(=C(C=C2)N3CCOCC3)C(=O)O

Isomeric SMILES

CCOC1=C(C=CC=C1OC)CNC2=CC(=C(C=C2)N3CCOCC3)C(=O)O

InChI

InChI=1S/C21H26N2O5/c1-3-28-20-15(5-4-6-19(20)26-2)14-22-16-7-8-18(17(13-16)21(24)25)23-9-11-27-12-10-23/h4-8,13,22H,3,9-12,14H2,1-2H3,(H,24,25)