2-(3,4-dimethoxyphenyl)ethyl-[(2R)-3-(3-methoxycarbonylphenoxy)-2-oxidanyl-propyl]-methyl-azanium

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-[(2R)-3-(3-methoxycarbonylphenoxy)-2-oxidanyl-propyl]-methyl-azanium Openeye Name: 2-(3,4-dimethoxyphenyl)ethyl-[(2R)-2-hydroxy-3-(3-methoxycarbonylphenoxy)propyl]-methyl-ammonium CAS Name: 2-(3,4-dimethoxyphenyl)ethyl-[(2R)-2-hydroxy-3-(3-methoxycarbonylphenoxy)propyl]-methylammonium IUPAC Name: 2-(3,4-dimethoxyphenyl)ethyl-[(2R)-2-hydroxy-3-(3-methoxycarbonylphenoxy)propyl]-methylazanium Traditional Name: [(2R)-3-(3-carbomethoxyphenoxy)-2-hydroxy-propyl]-homoveratryl-methyl-ammonium Formula: C22H30NO6+ MolecularWeight: 404.4767

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC(=C(C=C1)OC)OC)CC(COC2=CC=CC(=C2)C(=O)OC)O

Isomeric SMILES

C[NH+](CCC1=CC(=C(C=C1)OC)OC)C[C@H](COC2=CC=CC(=C2)C(=O)OC)O

InChI

InChI=1S/C22H29NO6/c1-23(11-10-16-8-9-20(26-2)21(12-16)27-3)14-18(24)15-29-19-7-5-6-17(13-19)22(25)28-4/h5-9,12-13,18,24H,10-11,14-15H2,1-4H3/p+1/t18-/m1/s1