[(2R)-3-[2-methoxy-5-(pyrrolidin-1-ium-1-ylmethyl)phenoxy]-2-oxidanyl-propyl]-methyl-(phenylmethyl)azanium

Systemtic Name: [(2R)-3-[2-methoxy-5-(pyrrolidin-1-ium-1-ylmethyl)phenoxy]-2-oxidanyl-propyl]-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[(2R)-2-hydroxy-3-[2-methoxy-5-(pyrrolidin-1-ium-1-ylmethyl)phenoxy]propyl]-methyl-ammonium CAS Name: [(2R)-2-hydroxy-3-[2-methoxy-5-(1-pyrrolidin-1-iumylmethyl)phenoxy]propyl]-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[(2R)-2-hydroxy-3-[2-methoxy-5-(pyrrolidin-1-ium-1-ylmethyl)phenoxy]propyl]-methylazanium Traditional Name: benzyl-[(2R)-2-hydroxy-3-[2-methoxy-5-(pyrrolidin-1-ium-1-ylmethyl)phenoxy]propyl]-methyl-ammonium Formula: C23H34N2O3+2 MolecularWeight: 386.52766

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)CC(COC2=C(C=CC(=C2)C[NH+]3CCCC3)OC)O

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)C[C@H](COC2=C(C=CC(=C2)C[NH+]3CCCC3)OC)O

InChI

InChI=1S/C23H32N2O3/c1-24(15-19-8-4-3-5-9-19)17-21(26)18-28-23-14-20(10-11-22(23)27-2)16-25-12-6-7-13-25/h3-5,8-11,14,21,26H,6-7,12-13,15-18H2,1-2H3/p+2/t21-/m1/s1