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1,5-dihydro-2,4-benzodioxepin-3-ylmethyl-diethyl-methyl-azanium iodide

1,5-dihydro-2,4-benzodioxepin-3-ylmethyl-diethyl-methyl-azanium iodide

Systemtic Name:1,5-dihydro-2,4-benzodioxepin-3-ylmethyl-diethyl-methyl-azanium iodide
Openeye Name:1,5-dihydro-2,4-benzodioxepin-3-ylmethyl-diethyl-methyl-ammonium iodide
CAS Name:1,5-dihydro-2,4-benzodioxepin-3-ylmethyl-diethyl-methylammonium iodide
IUPAC Name:1,5-dihydro-2,4-benzodioxepin-3-ylmethyl-diethyl-methylazanium iodide
Traditional Name:1,5-dihydro-2,4-benzodioxepin-3-ylmethyl-diethyl-methyl-ammonium iodide
Formula: C15H24INO2
MolecularWeight: 377.26103
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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CC)CC1OCC2=CC=CC=C2CO1.[I-]


Isomeric SMILES

CC[N+](C)(CC)CC1OCC2=CC=CC=C2CO1.[I-]


InChI

InChI=1S/C15H24NO2.HI/c1-4-16(3,5-2)10-15-17-11-13-8-6-7-9-14(13)12-18-15;/h6-9,15H,4-5,10-12H2,1-3H3;1H/q+1;/p-1


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