[(2R)-2-(4-hexoxyphenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethyl]azanium

Systemtic Name: [(2R)-2-(4-hexoxyphenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethyl]azanium Openeye Name: [(2R)-2-(4-hexoxyphenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethyl]ammonium CAS Name: [(2R)-2-(4-hexoxyphenyl)-2-[(2S)-2-methyl-1-piperidin-1-iumyl]ethyl]ammonium IUPAC Name: [(2R)-2-(4-hexoxyphenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethyl]azanium Traditional Name: [(2R)-2-(4-hexoxyphenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethyl]ammonium Formula: C20H36N2O+2 MolecularWeight: 320.51264

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(C[NH3+])[NH+]2CCCCC2C

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)[C@H](C[NH3+])[NH+]2CCCC[C@@H]2C

InChI

InChI=1S/C20H34N2O/c1-3-4-5-8-15-23-19-12-10-18(11-13-19)20(16-21)22-14-7-6-9-17(22)2/h10-13,17,20H,3-9,14-16,21H2,1-2H3/p+2/t17-,20-/m0/s1