1-piperidin-1-ium-1-ylpropan-2-yl N-ethyl-N-(3-hexoxyphenyl)carbamate chloride

Systemtic Name: 1-piperidin-1-ium-1-ylpropan-2-yl N-ethyl-N-(3-hexoxyphenyl)carbamate chloride Openeye Name: (1-methyl-2-piperidin-1-ium-1-yl-ethyl) N-ethyl-N-(3-hexoxyphenyl)carbamate chloride CAS Name: N-ethyl-N-(3-hexoxyphenyl)carbamic acid 1-(1-piperidin-1-iumyl)propan-2-yl ester chloride IUPAC Name: 1-piperidin-1-ium-1-ylpropan-2-yl N-ethyl-N-(3-hexoxyphenyl)carbamate chloride Traditional Name: N-ethyl-N-(3-hexoxyphenyl)carbamic acid (1-methyl-2-piperidin-1-ium-1-yl-ethyl) ester chloride Formula: C23H39ClN2O3 MolecularWeight: 427.02036

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC(=C1)N(CC)C(=O)OC(C)C[NH+]2CCCCC2.[Cl-]

Isomeric SMILES

CCCCCCOC1=CC=CC(=C1)N(CC)C(=O)OC(C)C[NH+]2CCCCC2.[Cl-]

InChI

InChI=1S/C23H38N2O3.ClH/c1-4-6-7-11-17-27-22-14-12-13-21(18-22)25(5-2)23(26)28-20(3)19-24-15-9-8-10-16-24;/h12-14,18,20H,4-11,15-17,19H2,1-3H3;1H