1,3-benzodioxol-5-ylmethyl-[(3-propan-2-yloxyphenyl)methyl]azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[(3-propan-2-yloxyphenyl)methyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[(3-isopropoxyphenyl)methyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[(3-propan-2-yloxyphenyl)methyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[(3-propan-2-yloxyphenyl)methyl]azanium Traditional Name: (3-isopropoxybenzyl)-piperonyl-ammonium Formula: C18H22NO3+ MolecularWeight: 300.37218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)C[NH2+]CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)C[NH2+]CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H21NO3/c1-13(2)22-16-5-3-4-14(8-16)10-19-11-15-6-7-17-18(9-15)21-12-20-17/h3-9,13,19H,10-12H2,1-2H3/p+1