1-pyrrolidin-1-ium-1-ylpropan-2-yl N-(4-pentoxyphenyl)carbamate chloride

Systemtic Name: 1-pyrrolidin-1-ium-1-ylpropan-2-yl N-(4-pentoxyphenyl)carbamate chloride Openeye Name: (1-methyl-2-pyrrolidin-1-ium-1-yl-ethyl) N-(4-pentoxyphenyl)carbamate chloride CAS Name: N-(4-pentoxyphenyl)carbamic acid 1-(1-pyrrolidin-1-iumyl)propan-2-yl ester chloride IUPAC Name: 1-pyrrolidin-1-ium-1-ylpropan-2-yl N-(4-pentoxyphenyl)carbamate chloride Traditional Name: N-(4-amoxyphenyl)carbamic acid (1-methyl-2-pyrrolidin-1-ium-1-yl-ethyl) ester chloride Formula: C19H31ClN2O3 MolecularWeight: 370.91404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)NC(=O)OC(C)C[NH+]2CCCC2.[Cl-]

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)NC(=O)OC(C)C[NH+]2CCCC2.[Cl-]

InChI

InChI=1S/C19H30N2O3.ClH/c1-3-4-7-14-23-18-10-8-17(9-11-18)20-19(22)24-16(2)15-21-12-5-6-13-21;/h8-11,16H,3-7,12-15H2,1-2H3,(H,20,22);1H