[1-(1-ethynylcyclohexyl)azetidin-1-ium-3-yl] N-methylcarbamate chloride

Systemtic Name: [1-(1-ethynylcyclohexyl)azetidin-1-ium-3-yl] N-methylcarbamate chloride Openeye Name: [1-(1-ethynylcyclohexyl)azetidin-1-ium-3-yl] N-methylcarbamate chloride CAS Name: N-methylcarbamic acid [1-(1-ethynylcyclohexyl)-3-azetidin-1-iumyl] ester chloride IUPAC Name: [1-(1-ethynylcyclohexyl)azetidin-1-ium-3-yl] N-methylcarbamate chloride Traditional Name: N-methylcarbamic acid [1-(1-ethynylcyclohexyl)azetidin-1-ium-3-yl] ester chloride Formula: C13H21ClN2O2 MolecularWeight: 272.77104

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)OC1C[NH+](C1)C2(CCCCC2)C#C.[Cl-]

Isomeric SMILES

CNC(=O)OC1C[NH+](C1)C2(CCCCC2)C#C.[Cl-]

InChI

InChI=1S/C13H20N2O2.ClH/c1-3-13(7-5-4-6-8-13)15-9-11(10-15)17-12(16)14-2;/h1,11H,4-10H2,2H3,(H,14,16);1H