[(2R)-3-(1,3-benzodioxol-5-ylmethoxy)-2-oxidanyl-propyl]-[(3-methoxyphenyl)methyl]-methyl-azanium

Systemtic Name: [(2R)-3-(1,3-benzodioxol-5-ylmethoxy)-2-oxidanyl-propyl]-[(3-methoxyphenyl)methyl]-methyl-azanium Openeye Name: [(2R)-3-(1,3-benzodioxol-5-ylmethoxy)-2-hydroxy-propyl]-[(3-methoxyphenyl)methyl]-methyl-ammonium CAS Name: [(2R)-3-(1,3-benzodioxol-5-ylmethoxy)-2-hydroxypropyl]-[(3-methoxyphenyl)methyl]-methylammonium IUPAC Name: [(2R)-3-(1,3-benzodioxol-5-ylmethoxy)-2-hydroxypropyl]-[(3-methoxyphenyl)methyl]-methylazanium Traditional Name: [(2R)-2-hydroxy-3-piperonyloxy-propyl]-m-anisyl-methyl-ammonium Formula: C20H26NO5+ MolecularWeight: 360.42414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC(=CC=C1)OC)CC(COCC2=CC3=C(C=C2)OCO3)O

Isomeric SMILES

C[NH+](CC1=CC(=CC=C1)OC)C[C@H](COCC2=CC3=C(C=C2)OCO3)O

InChI

InChI=1S/C20H25NO5/c1-21(10-15-4-3-5-18(8-15)23-2)11-17(22)13-24-12-16-6-7-19-20(9-16)26-14-25-19/h3-9,17,22H,10-14H2,1-2H3/p+1/t17-/m1/s1