[(2R)-2-(3-ethoxyphenyl)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]ethyl]azanium

Systemtic Name: [(2R)-2-(3-ethoxyphenyl)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]ethyl]azanium Openeye Name: [(2R)-2-(3-ethoxyphenyl)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]ethyl]ammonium CAS Name: [(2R)-2-(3-ethoxyphenyl)-2-[(2S)-2-ethyl-1-piperidin-1-iumyl]ethyl]ammonium IUPAC Name: [(2R)-2-(3-ethoxyphenyl)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]ethyl]azanium Traditional Name: [(2R)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-2-m-phenetyl-ethyl]ammonium Formula: C17H30N2O+2 MolecularWeight: 278.4329

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1C(C[NH3+])C2=CC(=CC=C2)OCC

Isomeric SMILES

CC[C@H]1CCCC[NH+]1[C@@H](C[NH3+])C2=CC(=CC=C2)OCC

InChI

InChI=1S/C17H28N2O/c1-3-15-9-5-6-11-19(15)17(13-18)14-8-7-10-16(12-14)20-4-2/h7-8,10,12,15,17H,3-6,9,11,13,18H2,1-2H3/p+2/t15-,17-/m0/s1