3-[4-[(1-phenylpiperidin-2-yl)carbonylamino]phenyl]propanoic acid

Systemtic Name: 3-[4-[(1-phenylpiperidin-2-yl)carbonylamino]phenyl]propanoic acid Openeye Name: 3-[4-[(1-phenylpiperidine-2-carbonyl)amino]phenyl]propanoic acid CAS Name: 3-[4-[[oxo-(1-phenyl-2-piperidinyl)methyl]amino]phenyl]propanoic acid IUPAC Name: 3-[4-[(1-phenylpiperidine-2-carbonyl)amino]phenyl]propanoic acid Traditional Name: 3-[4-[(1-phenylpipecoloyl)amino]phenyl]propionic acid Formula: C21H24N2O3 MolecularWeight: 352.42686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)NC2=CC=C(C=C2)CCC(=O)O)C3=CC=CC=C3

Isomeric SMILES

C1CCN(C(C1)C(=O)NC2=CC=C(C=C2)CCC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C21H24N2O3/c24-20(25)14-11-16-9-12-17(13-10-16)22-21(26)19-8-4-5-15-23(19)18-6-2-1-3-7-18/h1-3,6-7,9-10,12-13,19H,4-5,8,11,14-15H2,(H,22,26)(H,24,25)