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

Systemtic Name: [(2R)-2-(3-methoxy-4-propoxy-phenyl)-2-piperidin-1-ium-1-yl-ethyl]azanium Openeye Name: [(2R)-2-(3-methoxy-4-propoxy-phenyl)-2-piperidin-1-ium-1-yl-ethyl]ammonium CAS Name: [(2R)-2-(3-methoxy-4-propoxyphenyl)-2-(1-piperidin-1-iumyl)ethyl]ammonium IUPAC Name: [(2R)-2-(3-methoxy-4-propoxyphenyl)-2-piperidin-1-ium-1-ylethyl]azanium Traditional Name: [(2R)-2-(3-methoxy-4-propoxy-phenyl)-2-piperidin-1-ium-1-yl-ethyl]ammonium Formula: C17H30N2O2+2 MolecularWeight: 294.4323

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(C[NH3+])[NH+]2CCCCC2)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)[C@H](C[NH3+])[NH+]2CCCCC2)OC

InChI

InChI=1S/C17H28N2O2/c1-3-11-21-16-8-7-14(12-17(16)20-2)15(13-18)19-9-5-4-6-10-19/h7-8,12,15H,3-6,9-11,13,18H2,1-2H3/p+2/t15-/m0/s1