[(2R)-2-(2-hexoxy-3-methoxy-phenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]azanium

Systemtic Name: [(2R)-2-(2-hexoxy-3-methoxy-phenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]azanium Openeye Name: [(2R)-2-(2-hexoxy-3-methoxy-phenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]ammonium CAS Name: [(2R)-2-(2-hexoxy-3-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]ammonium IUPAC Name: [(2R)-2-(2-hexoxy-3-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]azanium Traditional Name: [(2R)-2-(2-hexoxy-3-methoxy-phenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]ammonium Formula: C19H34N2O2+2 MolecularWeight: 322.48546

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=CC=C1OC)C(C[NH3+])[NH+]2CCCC2

Isomeric SMILES

CCCCCCOC1=C(C=CC=C1OC)[C@H](C[NH3+])[NH+]2CCCC2

InChI

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