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

Systemtic Name: [(2R)-2-(2-ethoxyphenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethyl]azanium Openeye Name: [(2R)-2-(2-ethoxyphenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethyl]ammonium CAS Name: [(2R)-2-(2-ethoxyphenyl)-2-[(2S)-2-methyl-1-piperidin-1-iumyl]ethyl]ammonium IUPAC Name: [(2R)-2-(2-ethoxyphenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethyl]azanium Traditional Name: [(2R)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]-2-o-phenetyl-ethyl]ammonium Formula: C16H28N2O+2 MolecularWeight: 264.40632

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(C[NH3+])[NH+]2CCCCC2C

Isomeric SMILES

CCOC1=CC=CC=C1[C@H](C[NH3+])[NH+]2CCCC[C@@H]2C

InChI

InChI=1S/C16H26N2O/c1-3-19-16-10-5-4-9-14(16)15(12-17)18-11-7-6-8-13(18)2/h4-5,9-10,13,15H,3,6-8,11-12,17H2,1-2H3/p+2/t13-,15-/m0/s1