[1-[[2-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)ethanoylamino]methyl]cyclohexyl]-dimethyl-azanium

Systemtic Name: [1-[[2-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)ethanoylamino]methyl]cyclohexyl]-dimethyl-azanium Openeye Name: [1-[[[2-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)acetyl]amino]methyl]cyclohexyl]-dimethyl-ammonium CAS Name: [1-[[[2-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1-oxoethyl]amino]methyl]cyclohexyl]-dimethylammonium IUPAC Name: [1-[[[2-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)acetyl]amino]methyl]cyclohexyl]-dimethylazanium Traditional Name: [1-[[[2-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)acetyl]amino]methyl]cyclohexyl]-dimethyl-ammonium Formula: C19H28BrN2O3+ MolecularWeight: 412.34122

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C1(CCCCC1)CNC(=O)CC2=CC3=C(C=C2Br)OCCO3

Isomeric SMILES

C[NH+](C)C1(CCCCC1)CNC(=O)CC2=CC3=C(C=C2Br)OCCO3

InChI

InChI=1S/C19H27BrN2O3/c1-22(2)19(6-4-3-5-7-19)13-21-18(23)11-14-10-16-17(12-15(14)20)25-9-8-24-16/h10,12H,3-9,11,13H2,1-2H3,(H,21,23)/p+1