3-[(4-tert-butylphenyl)methyl-(pyridin-3-ylmethyl)amino]propanoic acid

Systemtic Name: 3-[(4-tert-butylphenyl)methyl-(pyridin-3-ylmethyl)amino]propanoic acid Openeye Name: 3-[(4-tert-butylphenyl)methyl-(3-pyridylmethyl)amino]propanoic acid CAS Name: 3-[(4-tert-butylphenyl)methyl-(3-pyridinylmethyl)amino]propanoic acid IUPAC Name: 3-[(4-tert-butylphenyl)methyl-(pyridin-3-ylmethyl)amino]propanoic acid Traditional Name: 3-[(4-tert-butylbenzyl)-(3-pyridylmethyl)amino]propionic acid Formula: C20H26N2O2 MolecularWeight: 326.43264

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N2O2/c1-20(2,3)18-8-6-16(7-9-18)14-22(12-10-19(23)24)15-17-5-4-11-21-13-17/h4-9,11,13H,10,12,14-15H2,1-3H3,(H,23,24)