3-[4-[(3,4-dichlorophenyl)methylamino]phenyl]propanoic acid

Systemtic Name: 3-[4-[(3,4-dichlorophenyl)methylamino]phenyl]propanoic acid Openeye Name: 3-[4-[(3,4-dichlorophenyl)methylamino]phenyl]propanoic acid CAS Name: 3-[4-[(3,4-dichlorophenyl)methylamino]phenyl]propanoic acid IUPAC Name: 3-[4-[(3,4-dichlorophenyl)methylamino]phenyl]propanoic acid Traditional Name: 3-[4-[(3,4-dichlorobenzyl)amino]phenyl]propionic acid Formula: C16H15Cl2NO2 MolecularWeight: 324.2018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(=O)O)NCC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

C1=CC(=CC=C1CCC(=O)O)NCC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C16H15Cl2NO2/c17-14-7-3-12(9-15(14)18)10-19-13-5-1-11(2-6-13)4-8-16(20)21/h1-3,5-7,9,19H,4,8,10H2,(H,20,21)