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1,5-dihydro-2,4-benzodioxepin-3-ylmethyl(3-methylbutyl)azanium

1,5-dihydro-2,4-benzodioxepin-3-ylmethyl(3-methylbutyl)azanium

Systemtic Name:1,5-dihydro-2,4-benzodioxepin-3-ylmethyl(3-methylbutyl)azanium
Openeye Name:1,5-dihydro-2,4-benzodioxepin-3-ylmethyl(isopentyl)ammonium
CAS Name:1,5-dihydro-2,4-benzodioxepin-3-ylmethyl(3-methylbutyl)ammonium
IUPAC Name:1,5-dihydro-2,4-benzodioxepin-3-ylmethyl(3-methylbutyl)azanium
Traditional Name:1,5-dihydro-2,4-benzodioxepin-3-ylmethyl(isoamyl)ammonium
Formula: C15H24NO2+
MolecularWeight: 250.35656
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC[NH2+]CC1OCC2=CC=CC=C2CO1


Isomeric SMILES

CC(C)CC[NH2+]CC1OCC2=CC=CC=C2CO1


InChI

InChI=1S/C15H23NO2/c1-12(2)7-8-16-9-15-17-10-13-5-3-4-6-14(13)11-18-15/h3-6,12,15-16H,7-11H2,1-2H3/p+1


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