[(2R)-2-(4-butoxy-3-ethoxy-phenyl)-2-piperidin-1-ium-1-yl-ethyl]azanium

Systemtic Name: [(2R)-2-(4-butoxy-3-ethoxy-phenyl)-2-piperidin-1-ium-1-yl-ethyl]azanium Openeye Name: [(2R)-2-(4-butoxy-3-ethoxy-phenyl)-2-piperidin-1-ium-1-yl-ethyl]ammonium CAS Name: [(2R)-2-(4-butoxy-3-ethoxyphenyl)-2-(1-piperidin-1-iumyl)ethyl]ammonium IUPAC Name: [(2R)-2-(4-butoxy-3-ethoxyphenyl)-2-piperidin-1-ium-1-ylethyl]azanium Traditional Name: [(2R)-2-(4-butoxy-3-ethoxy-phenyl)-2-piperidin-1-ium-1-yl-ethyl]ammonium Formula: C19H34N2O2+2 MolecularWeight: 322.48546

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(C[NH3+])[NH+]2CCCCC2)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)[C@H](C[NH3+])[NH+]2CCCCC2)OCC

InChI

InChI=1S/C19H32N2O2/c1-3-5-13-23-18-10-9-16(14-19(18)22-4-2)17(15-20)21-11-7-6-8-12-21/h9-10,14,17H,3-8,11-13,15,20H2,1-2H3/p+2/t17-/m0/s1