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

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

Systemtic Name:1,3-benzodioxol-5-ylmethyl-[(3-ethoxy-4-methoxy-phenyl)methyl]azanium
Openeye Name:1,3-benzodioxol-5-ylmethyl-[(3-ethoxy-4-methoxy-phenyl)methyl]ammonium
CAS Name:1,3-benzodioxol-5-ylmethyl-[(3-ethoxy-4-methoxyphenyl)methyl]ammonium
IUPAC Name:1,3-benzodioxol-5-ylmethyl-[(3-ethoxy-4-methoxyphenyl)methyl]azanium
Traditional Name:(3-ethoxy-4-methoxy-benzyl)-piperonyl-ammonium
Formula: C18H22NO4+
MolecularWeight: 316.37158
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C18H21NO4/c1-3-21-17-8-13(4-6-15(17)20-2)10-19-11-14-5-7-16-18(9-14)23-12-22-16/h4-9,19H,3,10-12H2,1-2H3/p+1


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