[(1R,2R)-2-pyrrolidin-1-ium-1-ylcyclohexyl] N-(2-pentoxyphenyl)carbamate chloride

Systemtic Name: [(1R,2R)-2-pyrrolidin-1-ium-1-ylcyclohexyl] N-(2-pentoxyphenyl)carbamate chloride Openeye Name: [(1R,2R)-2-pyrrolidin-1-ium-1-ylcyclohexyl] N-(2-pentoxyphenyl)carbamate chloride CAS Name: N-(2-pentoxyphenyl)carbamic acid [(1R,2R)-2-(1-pyrrolidin-1-iumyl)cyclohexyl] ester chloride IUPAC Name: [(1R,2R)-2-pyrrolidin-1-ium-1-ylcyclohexyl] N-(2-pentoxyphenyl)carbamate chloride Traditional Name: N-(2-amoxyphenyl)carbamic acid [(1R,2R)-2-pyrrolidin-1-ium-1-ylcyclohexyl] ester chloride Formula: C22H35ClN2O3 MolecularWeight: 410.9779

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC=C1NC(=O)OC2CCCCC2[NH+]3CCCC3.[Cl-]

Isomeric SMILES

CCCCCOC1=CC=CC=C1NC(=O)O[C@@H]2CCCC[C@H]2[NH+]3CCCC3.[Cl-]

InChI

InChI=1S/C22H34N2O3.ClH/c1-2-3-10-17-26-20-13-6-4-11-18(20)23-22(25)27-21-14-7-5-12-19(21)24-15-8-9-16-24;/h4,6,11,13,19,21H,2-3,5,7-10,12,14-17H2,1H3,(H,23,25);1H/t19-,21-;/m1./s1