3-(3-cyanophenyl)-5-[[4-(dimethylamino)phenoxy]methyl]benzoic acid

Systemtic Name: 3-(3-cyanophenyl)-5-[[4-(dimethylamino)phenoxy]methyl]benzoic acid Openeye Name: 3-(3-cyanophenyl)-5-[[4-(dimethylamino)phenoxy]methyl]benzoic acid CAS Name: 3-(3-cyanophenyl)-5-[[4-(dimethylamino)phenoxy]methyl]benzoic acid IUPAC Name: 3-(3-cyanophenyl)-5-[[4-(dimethylamino)phenoxy]methyl]benzoic acid Traditional Name: 3-(3-cyanophenyl)-5-[[4-(dimethylamino)phenoxy]methyl]benzoic acid Formula: C23H20N2O3 MolecularWeight: 372.4165

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)OCC2=CC(=CC(=C2)C(=O)O)C3=CC=CC(=C3)C#N

Isomeric SMILES

CN(C)C1=CC=C(C=C1)OCC2=CC(=CC(=C2)C(=O)O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C23H20N2O3/c1-25(2)21-6-8-22(9-7-21)28-15-17-11-19(13-20(12-17)23(26)27)18-5-3-4-16(10-18)14-24/h3-13H,15H2,1-2H3,(H,26,27)