1,3-benzodioxol-5-ylmethyl-[(2-methoxyphenyl)methyl]-[(2S)-2-oxidanylpropyl]azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[(2-methoxyphenyl)methyl]-[(2S)-2-oxidanylpropyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[(2S)-2-hydroxypropyl]-[(2-methoxyphenyl)methyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[(2S)-2-hydroxypropyl]-[(2-methoxyphenyl)methyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[(2S)-2-hydroxypropyl]-[(2-methoxyphenyl)methyl]azanium Traditional Name: [(2S)-2-hydroxypropyl]-o-anisyl-piperonyl-ammonium Formula: C19H24NO4+ MolecularWeight: 330.39816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH+](CC1=CC2=C(C=C1)OCO2)CC3=CC=CC=C3OC)O

Isomeric SMILES

C[C@@H](C[NH+](CC1=CC2=C(C=C1)OCO2)CC3=CC=CC=C3OC)O

InChI

InChI=1S/C19H23NO4/c1-14(21)10-20(12-16-5-3-4-6-17(16)22-2)11-15-7-8-18-19(9-15)24-13-23-18/h3-9,14,21H,10-13H2,1-2H3/p+1/t14-/m0/s1