3-[(3,4-dichlorophenyl)methyl-(pyridin-3-ylmethyl)amino]propanoic acid

Systemtic Name: 3-[(3,4-dichlorophenyl)methyl-(pyridin-3-ylmethyl)amino]propanoic acid Openeye Name: 3-[(3,4-dichlorophenyl)methyl-(3-pyridylmethyl)amino]propanoic acid CAS Name: 3-[(3,4-dichlorophenyl)methyl-(3-pyridinylmethyl)amino]propanoic acid IUPAC Name: 3-[(3,4-dichlorophenyl)methyl-(pyridin-3-ylmethyl)amino]propanoic acid Traditional Name: 3-[(3,4-dichlorobenzyl)-(3-pyridylmethyl)amino]propionic acid Formula: C16H16Cl2N2O2 MolecularWeight: 339.21644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CN(CCC(=O)O)CC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

C1=CC(=CN=C1)CN(CCC(=O)O)CC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C16H16Cl2N2O2/c17-14-4-3-12(8-15(14)18)10-20(7-5-16(21)22)11-13-2-1-6-19-9-13/h1-4,6,8-9H,5,7,10-11H2,(H,21,22)