(2R)-2-ethyl-1-[(3-phenoxyphenyl)methyl]piperidin-1-ium

Systemtic Name: (2R)-2-ethyl-1-[(3-phenoxyphenyl)methyl]piperidin-1-ium Openeye Name: (2R)-2-ethyl-1-[(3-phenoxyphenyl)methyl]piperidin-1-ium CAS Name: (2R)-2-ethyl-1-[(3-phenoxyphenyl)methyl]piperidin-1-ium IUPAC Name: (2R)-2-ethyl-1-[(3-phenoxyphenyl)methyl]piperidin-1-ium Traditional Name: (2R)-2-ethyl-1-(3-phenoxybenzyl)piperidin-1-ium Formula: C20H26NO+ MolecularWeight: 296.42654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1CC2=CC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CC[C@@H]1CCCC[NH+]1CC2=CC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C20H25NO/c1-2-18-10-6-7-14-21(18)16-17-9-8-13-20(15-17)22-19-11-4-3-5-12-19/h3-5,8-9,11-13,15,18H,2,6-7,10,14,16H2,1H3/p+1/t18-/m1/s1