[(1R)-1-phenyl-2-piperidin-1-ium-1-yl-ethyl]-propan-2-yl-azanium

Systemtic Name: [(1R)-1-phenyl-2-piperidin-1-ium-1-yl-ethyl]-propan-2-yl-azanium Openeye Name: isopropyl-[(1R)-1-phenyl-2-piperidin-1-ium-1-yl-ethyl]ammonium CAS Name: [(1R)-1-phenyl-2-(1-piperidin-1-iumyl)ethyl]-propan-2-ylammonium IUPAC Name: [(1R)-1-phenyl-2-piperidin-1-ium-1-ylethyl]-propan-2-ylazanium Traditional Name: isopropyl-[(1R)-1-phenyl-2-piperidin-1-ium-1-yl-ethyl]ammonium Formula: C16H28N2+2 MolecularWeight: 248.40692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH2+]C(C[NH+]1CCCCC1)C2=CC=CC=C2

Isomeric SMILES

CC(C)[NH2+][C@@H](C[NH+]1CCCCC1)C2=CC=CC=C2

InChI

InChI=1S/C16H26N2/c1-14(2)17-16(15-9-5-3-6-10-15)13-18-11-7-4-8-12-18/h3,5-6,9-10,14,16-17H,4,7-8,11-13H2,1-2H3/p+2/t16-/m0/s1