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

Systemtic Name: 1-piperidin-1-ium-1-ylpropan-2-yl N-(4-pentoxyphenyl)carbamate chloride Openeye Name: (1-methyl-2-piperidin-1-ium-1-yl-ethyl) N-(4-pentoxyphenyl)carbamate chloride CAS Name: N-(4-pentoxyphenyl)carbamic acid 1-(1-piperidin-1-iumyl)propan-2-yl ester chloride IUPAC Name: 1-piperidin-1-ium-1-ylpropan-2-yl N-(4-pentoxyphenyl)carbamate chloride Traditional Name: N-(4-amoxyphenyl)carbamic acid (1-methyl-2-piperidin-1-ium-1-yl-ethyl) ester chloride Formula: C20H33ClN2O3 MolecularWeight: 384.94062

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)NC(=O)OC(C)C[NH+]2CCCCC2.[Cl-]

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)NC(=O)OC(C)C[NH+]2CCCCC2.[Cl-]

InChI

InChI=1S/C20H32N2O3.ClH/c1-3-4-8-15-24-19-11-9-18(10-12-19)21-20(23)25-17(2)16-22-13-6-5-7-14-22;/h9-12,17H,3-8,13-16H2,1-2H3,(H,21,23);1H