4-phenyl-N-[[(3R)-piperidin-1-ium-3-yl]methyl]butanamide

Systemtic Name: 4-phenyl-N-[[(3R)-piperidin-1-ium-3-yl]methyl]butanamide Openeye Name: 4-phenyl-N-[[(3R)-piperidin-1-ium-3-yl]methyl]butanamide CAS Name: 4-phenyl-N-[[(3R)-3-piperidin-1-iumyl]methyl]butanamide IUPAC Name: 4-phenyl-N-[[(3R)-piperidin-1-ium-3-yl]methyl]butanamide Traditional Name: 4-phenyl-N-[[(3R)-piperidin-1-ium-3-yl]methyl]butyramide Formula: C16H25N2O+ MolecularWeight: 261.3825

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH2+]C1)CNC(=O)CCCC2=CC=CC=C2

Isomeric SMILES

C1C[C@@H](C[NH2+]C1)CNC(=O)CCCC2=CC=CC=C2

InChI

InChI=1S/C16H24N2O/c19-16(18-13-15-9-5-11-17-12-15)10-4-8-14-6-2-1-3-7-14/h1-3,6-7,15,17H,4-5,8-13H2,(H,18,19)/p+1/t15-/m0/s1