(2-pyrrolidin-1-ium-1-ylcyclohexyl) N-[2,6-bis(chloranyl)phenyl]carbamate chloride

Systemtic Name: (2-pyrrolidin-1-ium-1-ylcyclohexyl) N-[2,6-bis(chloranyl)phenyl]carbamate chloride Openeye Name: (2-pyrrolidin-1-ium-1-ylcyclohexyl) N-(2,6-dichlorophenyl)carbamate chloride CAS Name: N-(2,6-dichlorophenyl)carbamic acid [2-(1-pyrrolidin-1-iumyl)cyclohexyl] ester chloride IUPAC Name: (2-pyrrolidin-1-ium-1-ylcyclohexyl) N-(2,6-dichlorophenyl)carbamate chloride Traditional Name: N-(2,6-dichlorophenyl)carbamic acid (2-pyrrolidin-1-ium-1-ylcyclohexyl) ester chloride Formula: C17H23Cl3N2O2 MolecularWeight: 393.73572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)[NH+]2CCCC2)OC(=O)NC3=C(C=CC=C3Cl)Cl.[Cl-]

Isomeric SMILES

C1CCC(C(C1)[NH+]2CCCC2)OC(=O)NC3=C(C=CC=C3Cl)Cl.[Cl-]

InChI

InChI=1S/C17H22Cl2N2O2.ClH/c18-12-6-5-7-13(19)16(12)20-17(22)23-15-9-2-1-8-14(15)21-10-3-4-11-21;/h5-7,14-15H,1-4,8-11H2,(H,20,22);1H