4-[3-oxidanylidene-3-[phenyl(piperidin-1-yl)amino]propyl]benzoic acid

Systemtic Name: 4-[3-oxidanylidene-3-[phenyl(piperidin-1-yl)amino]propyl]benzoic acid Openeye Name: 4-[3-oxo-3-[N-(1-piperidyl)anilino]propyl]benzoic acid CAS Name: 4-[3-oxo-3-[N-(1-piperidinyl)anilino]propyl]benzoic acid IUPAC Name: 4-[3-oxo-3-(N-piperidin-1-ylanilino)propyl]benzoic acid Traditional Name: 4-[3-keto-3-(N-piperidinoanilino)propyl]benzoic acid Formula: C21H24N2O3 MolecularWeight: 352.42686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)N(C2=CC=CC=C2)C(=O)CCC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1CCN(CC1)N(C2=CC=CC=C2)C(=O)CCC3=CC=C(C=C3)C(=O)O

InChI

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