3-[(4-chlorophenyl)methyl-[(4-cyanophenyl)methyl]amino]propanoic acid

Systemtic Name: 3-[(4-chlorophenyl)methyl-[(4-cyanophenyl)methyl]amino]propanoic acid Openeye Name: 3-[(4-chlorophenyl)methyl-[(4-cyanophenyl)methyl]amino]propanoic acid CAS Name: 3-[(4-chlorophenyl)methyl-[(4-cyanophenyl)methyl]amino]propanoic acid IUPAC Name: 3-[(4-chlorophenyl)methyl-[(4-cyanophenyl)methyl]amino]propanoic acid Traditional Name: 3-[(4-chlorobenzyl)-(4-cyanobenzyl)amino]propionic acid Formula: C18H17ClN2O2 MolecularWeight: 328.79278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN(CCC(=O)O)CC2=CC=C(C=C2)Cl)C#N

Isomeric SMILES

C1=CC(=CC=C1CN(CCC(=O)O)CC2=CC=C(C=C2)Cl)C#N

InChI

InChI=1S/C18H17ClN2O2/c19-17-7-5-16(6-8-17)13-21(10-9-18(22)23)12-15-3-1-14(11-20)2-4-15/h1-8H,9-10,12-13H2,(H,22,23)