[(2R)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-2-(2-pentoxyphenyl)ethyl]azanium

Systemtic Name: [(2R)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-2-(2-pentoxyphenyl)ethyl]azanium Openeye Name: [(2R)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-2-(2-pentoxyphenyl)ethyl]ammonium CAS Name: [(2R)-2-[(2S)-2-ethyl-1-piperidin-1-iumyl]-2-(2-pentoxyphenyl)ethyl]ammonium IUPAC Name: [(2R)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-2-(2-pentoxyphenyl)ethyl]azanium Traditional Name: [(2R)-2-(2-amoxyphenyl)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]ethyl]ammonium Formula: C20H36N2O+2 MolecularWeight: 320.51264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC=C1C(C[NH3+])[NH+]2CCCCC2CC

Isomeric SMILES

CCCCCOC1=CC=CC=C1[C@H](C[NH3+])[NH+]2CCCC[C@@H]2CC

InChI

InChI=1S/C20H34N2O/c1-3-5-10-15-23-20-13-7-6-12-18(20)19(16-21)22-14-9-8-11-17(22)4-2/h6-7,12-13,17,19H,3-5,8-11,14-16,21H2,1-2H3/p+2/t17-,19-/m0/s1