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

Systemtic Name: dibutyl(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)azanium Openeye Name: dibutyl(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)ammonium CAS Name: dibutyl(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)ammonium IUPAC Name: dibutyl(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)azanium Traditional Name: dibutyl(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)ammonium Formula: C18H30NO2+ MolecularWeight: 292.4363

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CCCC)CC1OCC2=CC=CC=C2CO1

Isomeric SMILES

CCCC[NH+](CCCC)CC1OCC2=CC=CC=C2CO1

InChI

InChI=1S/C18H29NO2/c1-3-5-11-19(12-6-4-2)13-18-20-14-16-9-7-8-10-17(16)15-21-18/h7-10,18H,3-6,11-15H2,1-2H3/p+1