methyl-[(6-oxidanyl-1,3-benzodioxol-5-yl)methyl]-[(4-prop-2-enoxyphenyl)methyl]azanium

Systemtic Name: methyl-[(6-oxidanyl-1,3-benzodioxol-5-yl)methyl]-[(4-prop-2-enoxyphenyl)methyl]azanium Openeye Name: (4-allyloxyphenyl)methyl-[(6-hydroxy-1,3-benzodioxol-5-yl)methyl]-methyl-ammonium CAS Name: (6-hydroxy-1,3-benzodioxol-5-yl)methyl-methyl-[(4-prop-2-enoxyphenyl)methyl]ammonium IUPAC Name: (6-hydroxy-1,3-benzodioxol-5-yl)methyl-methyl-[(4-prop-2-enoxyphenyl)methyl]azanium Traditional Name: (4-allyloxybenzyl)-[(6-hydroxy-1,3-benzodioxol-5-yl)methyl]-methyl-ammonium Formula: C19H22NO4+ MolecularWeight: 328.38228

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)OCC=C)CC2=CC3=C(C=C2O)OCO3

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)OCC=C)CC2=CC3=C(C=C2O)OCO3

InChI

InChI=1S/C19H21NO4/c1-3-8-22-16-6-4-14(5-7-16)11-20(2)12-15-9-18-19(10-17(15)21)24-13-23-18/h3-7,9-10,21H,1,8,11-13H2,2H3/p+1