3-[(phenylmethyl)-propyl-amino]propanoic acid

Systemtic Name: 3-[(phenylmethyl)-propyl-amino]propanoic acid Openeye Name: 3-[benzyl(propyl)amino]propanoic acid CAS Name: 3-[(phenylmethyl)-propylamino]propanoic acid IUPAC Name: 3-[benzyl(propyl)amino]propanoic acid Traditional Name: 3-[benzyl(propyl)amino]propionic acid Formula: C13H19NO2 MolecularWeight: 221.29546

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC(=O)O)CC1=CC=CC=C1

Isomeric SMILES

CCCN(CCC(=O)O)CC1=CC=CC=C1

InChI

InChI=1S/C13H19NO2/c1-2-9-14(10-8-13(15)16)11-12-6-4-3-5-7-12/h3-7H,2,8-11H2,1H3,(H,15,16)