[(1R)-2-pyrrolidin-1-ium-1-ylcyclohexyl] N-(4-pentoxyphenyl)carbamate chloride

Systemtic Name: [(1R)-2-pyrrolidin-1-ium-1-ylcyclohexyl] N-(4-pentoxyphenyl)carbamate chloride Openeye Name: [(1R)-2-pyrrolidin-1-ium-1-ylcyclohexyl] N-(4-pentoxyphenyl)carbamate chloride CAS Name: N-(4-pentoxyphenyl)carbamic acid [(1R)-2-(1-pyrrolidin-1-iumyl)cyclohexyl] ester chloride IUPAC Name: [(1R)-2-pyrrolidin-1-ium-1-ylcyclohexyl] N-(4-pentoxyphenyl)carbamate chloride Traditional Name: N-(4-amoxyphenyl)carbamic acid [(1R)-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=C(C=C1)NC(=O)OC2CCCCC2[NH+]3CCCC3.[Cl-]

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)NC(=O)O[C@@H]2CCCCC2[NH+]3CCCC3.[Cl-]

InChI

InChI=1S/C22H34N2O3.ClH/c1-2-3-8-17-26-19-13-11-18(12-14-19)23-22(25)27-21-10-5-4-9-20(21)24-15-6-7-16-24;/h11-14,20-21H,2-10,15-17H2,1H3,(H,23,25);1H/t20?,21-;/m1./s1