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methyl-[(6-oxidanyl-1,3-benzodioxol-5-yl)methyl]-[2-oxidanylidene-2-(propylamino)ethyl]azanium

methyl-[(6-oxidanyl-1,3-benzodioxol-5-yl)methyl]-[2-oxidanylidene-2-(propylamino)ethyl]azanium

Systemtic Name:methyl-[(6-oxidanyl-1,3-benzodioxol-5-yl)methyl]-[2-oxidanylidene-2-(propylamino)ethyl]azanium
Openeye Name:(6-hydroxy-1,3-benzodioxol-5-yl)methyl-methyl-[2-oxo-2-(propylamino)ethyl]ammonium
CAS Name:(6-hydroxy-1,3-benzodioxol-5-yl)methyl-methyl-[2-oxo-2-(propylamino)ethyl]ammonium
IUPAC Name:(6-hydroxy-1,3-benzodioxol-5-yl)methyl-methyl-[2-oxo-2-(propylamino)ethyl]azanium
Traditional Name:(6-hydroxy-1,3-benzodioxol-5-yl)methyl-[2-keto-2-(propylamino)ethyl]-methyl-ammonium
Formula: C14H21N2O4+
MolecularWeight: 281.32754
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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C[NH+](C)CC1=CC2=C(C=C1O)OCO2


Isomeric SMILES

CCCNC(=O)C[NH+](C)CC1=CC2=C(C=C1O)OCO2


InChI

InChI=1S/C14H20N2O4/c1-3-4-15-14(18)8-16(2)7-10-5-12-13(6-11(10)17)20-9-19-12/h5-6,17H,3-4,7-9H2,1-2H3,(H,15,18)/p+1


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