1,3-benzodioxol-5-ylmethyl-[(3-ethoxy-4-prop-2-enoxy-phenyl)methyl]azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[(3-ethoxy-4-prop-2-enoxy-phenyl)methyl]azanium Openeye Name: (4-allyloxy-3-ethoxy-phenyl)methyl-(1,3-benzodioxol-5-ylmethyl)ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[(3-ethoxy-4-prop-2-enoxyphenyl)methyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[(3-ethoxy-4-prop-2-enoxyphenyl)methyl]azanium Traditional Name: (4-allyloxy-3-ethoxy-benzyl)-piperonyl-ammonium Formula: C20H24NO4+ MolecularWeight: 342.40886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]CC2=CC3=C(C=C2)OCO3)OCC=C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+]CC2=CC3=C(C=C2)OCO3)OCC=C

InChI

InChI=1S/C20H23NO4/c1-3-9-23-17-7-5-15(10-19(17)22-4-2)12-21-13-16-6-8-18-20(11-16)25-14-24-18/h3,5-8,10-11,21H,1,4,9,12-14H2,2H3/p+1