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

Systemtic Name: 2-[(3-fluoranyl-4-piperidin-1-yl-phenyl)carbonylamino]-3-piperidin-1-yl-propanoic acid Openeye Name: 2-[[3-fluoro-4-(1-piperidyl)benzoyl]amino]-3-(1-piperidyl)propanoic acid CAS Name: 2-[[[3-fluoro-4-(1-piperidinyl)phenyl]-oxomethyl]amino]-3-(1-piperidinyl)propanoic acid IUPAC Name: 2-[(3-fluoro-4-piperidin-1-ylbenzoyl)amino]-3-piperidin-1-ylpropanoic acid Traditional Name: 2-[(3-fluoro-4-piperidino-benzoyl)amino]-3-piperidino-propionic acid Formula: C20H28FN3O3 MolecularWeight: 377.453023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC(C(=O)O)NC(=O)C2=CC(=C(C=C2)N3CCCCC3)F

Isomeric SMILES

C1CCN(CC1)CC(C(=O)O)NC(=O)C2=CC(=C(C=C2)N3CCCCC3)F

InChI

InChI=1S/C20H28FN3O3/c21-16-13-15(7-8-18(16)24-11-5-2-6-12-24)19(25)22-17(20(26)27)14-23-9-3-1-4-10-23/h7-8,13,17H,1-6,9-12,14H2,(H,22,25)(H,26,27)