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

Systemtic Name: [1-(1-ethynylcyclohexyl)azetidin-1-ium-3-yl] N-naphthalen-1-ylcarbamate chloride Openeye Name: [1-(1-ethynylcyclohexyl)azetidin-1-ium-3-yl] N-(1-naphthyl)carbamate chloride CAS Name: N-(1-naphthalenyl)carbamic acid [1-(1-ethynylcyclohexyl)-3-azetidin-1-iumyl] ester chloride IUPAC Name: [1-(1-ethynylcyclohexyl)azetidin-1-ium-3-yl] N-naphthalen-1-ylcarbamate chloride Traditional Name: N-(1-naphthyl)carbamic acid [1-(1-ethynylcyclohexyl)azetidin-1-ium-3-yl] ester chloride Formula: C22H25ClN2O2 MolecularWeight: 384.8991

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1(CCCCC1)[NH+]2CC(C2)OC(=O)NC3=CC=CC4=CC=CC=C43.[Cl-]

Isomeric SMILES

C#CC1(CCCCC1)[NH+]2CC(C2)OC(=O)NC3=CC=CC4=CC=CC=C43.[Cl-]

InChI

InChI=1S/C22H24N2O2.ClH/c1-2-22(13-6-3-7-14-22)24-15-18(16-24)26-21(25)23-20-12-8-10-17-9-4-5-11-19(17)20;/h1,4-5,8-12,18H,3,6-7,13-16H2,(H,23,25);1H