2-azanyl-3-[3-[3-(4-cyano-4-phenyl-piperidin-1-yl)phenyl]phenyl]propanoic acid

Systemtic Name: 2-azanyl-3-[3-[3-(4-cyano-4-phenyl-piperidin-1-yl)phenyl]phenyl]propanoic acid Openeye Name: 2-amino-3-[3-[3-(4-cyano-4-phenyl-1-piperidyl)phenyl]phenyl]propanoic acid CAS Name: 2-amino-3-[3-[3-(4-cyano-4-phenyl-1-piperidinyl)phenyl]phenyl]propanoic acid IUPAC Name: 2-amino-3-[3-[3-(4-cyano-4-phenylpiperidin-1-yl)phenyl]phenyl]propanoic acid Traditional Name: 2-amino-3-[3-[3-(4-cyano-4-phenyl-piperidino)phenyl]phenyl]propionic acid Formula: C27H27N3O2 MolecularWeight: 425.52218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C#N)C2=CC=CC=C2)C3=CC=CC(=C3)C4=CC(=CC=C4)CC(C(=O)O)N

Isomeric SMILES

C1CN(CCC1(C#N)C2=CC=CC=C2)C3=CC=CC(=C3)C4=CC(=CC=C4)CC(C(=O)O)N

InChI

InChI=1S/C27H27N3O2/c28-19-27(23-9-2-1-3-10-23)12-14-30(15-13-27)24-11-5-8-22(18-24)21-7-4-6-20(16-21)17-25(29)26(31)32/h1-11,16,18,25H,12-15,17,29H2,(H,31,32)