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2-hydroxyethyl-[(6-methoxy-1,3-benzodioxol-5-yl)methyl]-(pyridin-3-ylmethyl)azanium

2-hydroxyethyl-[(6-methoxy-1,3-benzodioxol-5-yl)methyl]-(pyridin-3-ylmethyl)azanium

Systemtic Name:2-hydroxyethyl-[(6-methoxy-1,3-benzodioxol-5-yl)methyl]-(pyridin-3-ylmethyl)azanium
Openeye Name:2-hydroxyethyl-[(6-methoxy-1,3-benzodioxol-5-yl)methyl]-(3-pyridylmethyl)ammonium
CAS Name:2-hydroxyethyl-[(6-methoxy-1,3-benzodioxol-5-yl)methyl]-(3-pyridinylmethyl)ammonium
IUPAC Name:2-hydroxyethyl-[(6-methoxy-1,3-benzodioxol-5-yl)methyl]-(pyridin-3-ylmethyl)azanium
Traditional Name:2-hydroxyethyl-[(6-methoxy-1,3-benzodioxol-5-yl)methyl]-(3-pyridylmethyl)ammonium
Formula: C17H21N2O4+
MolecularWeight: 317.35964
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1C[NH+](CCO)CC3=CN=CC=C3)OCO2


Isomeric SMILES

COC1=CC2=C(C=C1C[NH+](CCO)CC3=CN=CC=C3)OCO2


InChI

InChI=1S/C17H20N2O4/c1-21-15-8-17-16(22-12-23-17)7-14(15)11-19(5-6-20)10-13-3-2-4-18-9-13/h2-4,7-9,20H,5-6,10-12H2,1H3/p+1


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