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1,3-benzodioxol-5-ylmethyl-[(3-propoxyphenyl)methyl]azanium

1,3-benzodioxol-5-ylmethyl-[(3-propoxyphenyl)methyl]azanium

Systemtic Name:1,3-benzodioxol-5-ylmethyl-[(3-propoxyphenyl)methyl]azanium
Openeye Name:1,3-benzodioxol-5-ylmethyl-[(3-propoxyphenyl)methyl]ammonium
CAS Name:1,3-benzodioxol-5-ylmethyl-[(3-propoxyphenyl)methyl]ammonium
IUPAC Name:1,3-benzodioxol-5-ylmethyl-[(3-propoxyphenyl)methyl]azanium
Traditional Name:piperonyl-(3-propoxybenzyl)ammonium
Formula: C18H22NO3+
MolecularWeight: 300.37218
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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C[NH2+]CC2=CC3=C(C=C2)OCO3


Isomeric SMILES

CCCOC1=CC=CC(=C1)C[NH2+]CC2=CC3=C(C=C2)OCO3


InChI

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


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