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

Systemtic Name: 4-[[4-[(2-chlorophenyl)methoxy]-3-methoxy-phenyl]methylamino]benzoic acid Openeye Name: 4-[[4-[(2-chlorophenyl)methoxy]-3-methoxy-phenyl]methylamino]benzoic acid CAS Name: 4-[[4-[(2-chlorophenyl)methoxy]-3-methoxyphenyl]methylamino]benzoic acid IUPAC Name: 4-[[4-[(2-chlorophenyl)methoxy]-3-methoxyphenyl]methylamino]benzoic acid Traditional Name: 4-[[4-(2-chlorobenzyl)oxy-3-methoxy-benzyl]amino]benzoic acid Formula: C22H20ClNO4 MolecularWeight: 397.8515

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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=C3Cl

Isomeric SMILES

COC1=C(C=CC(=C1)CNC2=CC=C(C=C2)C(=O)O)OCC3=CC=CC=C3Cl

InChI

InChI=1S/C22H20ClNO4/c1-27-21-12-15(13-24-18-9-7-16(8-10-18)22(25)26)6-11-20(21)28-14-17-4-2-3-5-19(17)23/h2-12,24H,13-14H2,1H3,(H,25,26)