cyclohexyl-[(2R)-3-[2-methoxy-4-(pyrrolidin-1-ium-1-ylmethyl)phenoxy]-2-oxidanyl-propyl]-methyl-azanium

Systemtic Name: cyclohexyl-[(2R)-3-[2-methoxy-4-(pyrrolidin-1-ium-1-ylmethyl)phenoxy]-2-oxidanyl-propyl]-methyl-azanium Openeye Name: cyclohexyl-[(2R)-2-hydroxy-3-[2-methoxy-4-(pyrrolidin-1-ium-1-ylmethyl)phenoxy]propyl]-methyl-ammonium CAS Name: cyclohexyl-[(2R)-2-hydroxy-3-[2-methoxy-4-(1-pyrrolidin-1-iumylmethyl)phenoxy]propyl]-methylammonium IUPAC Name: cyclohexyl-[(2R)-2-hydroxy-3-[2-methoxy-4-(pyrrolidin-1-ium-1-ylmethyl)phenoxy]propyl]-methylazanium Traditional Name: cyclohexyl-[(2R)-2-hydroxy-3-[2-methoxy-4-(pyrrolidin-1-ium-1-ylmethyl)phenoxy]propyl]-methyl-ammonium Formula: C22H38N2O3+2 MolecularWeight: 378.54872

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC(COC1=C(C=C(C=C1)C[NH+]2CCCC2)OC)O)C3CCCCC3

Isomeric SMILES

C[NH+](C[C@H](COC1=C(C=C(C=C1)C[NH+]2CCCC2)OC)O)C3CCCCC3

InChI

InChI=1S/C22H36N2O3/c1-23(19-8-4-3-5-9-19)16-20(25)17-27-21-11-10-18(14-22(21)26-2)15-24-12-6-7-13-24/h10-11,14,19-20,25H,3-9,12-13,15-17H2,1-2H3/p+2/t20-/m1/s1