[1-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]carbonylamino]methyl]cyclohexyl]-dimethyl-azanium

Systemtic Name: [1-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]carbonylamino]methyl]cyclohexyl]-dimethyl-azanium Openeye Name: [1-[[[(3S)-2,3-dihydro-1,4-benzodioxine-3-carbonyl]amino]methyl]cyclohexyl]-dimethyl-ammonium CAS Name: [1-[[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-oxomethyl]amino]methyl]cyclohexyl]-dimethylammonium IUPAC Name: [1-[[[(3S)-2,3-dihydro-1,4-benzodioxine-3-carbonyl]amino]methyl]cyclohexyl]-dimethylazanium Traditional Name: [1-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-carbonyl]amino]methyl]cyclohexyl]-dimethyl-ammonium Formula: C18H27N2O3+ MolecularWeight: 319.41858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C1(CCCCC1)CNC(=O)C2COC3=CC=CC=C3O2

Isomeric SMILES

C[NH+](C)C1(CCCCC1)CNC(=O)[C@@H]2COC3=CC=CC=C3O2

InChI

InChI=1S/C18H26N2O3/c1-20(2)18(10-6-3-7-11-18)13-19-17(21)16-12-22-14-8-4-5-9-15(14)23-16/h4-5,8-9,16H,3,6-7,10-13H2,1-2H3,(H,19,21)/p+1/t16-/m0/s1