2-(2,4-dimethylpiperidin-1-ium-1-yl)ethyl N-(2-heptoxyphenyl)carbamate chloride

Systemtic Name: 2-(2,4-dimethylpiperidin-1-ium-1-yl)ethyl N-(2-heptoxyphenyl)carbamate chloride Openeye Name: 2-(2,4-dimethylpiperidin-1-ium-1-yl)ethyl N-(2-heptoxyphenyl)carbamate chloride CAS Name: N-(2-heptoxyphenyl)carbamic acid 2-(2,4-dimethyl-1-piperidin-1-iumyl)ethyl ester chloride IUPAC Name: 2-(2,4-dimethylpiperidin-1-ium-1-yl)ethyl N-(2-heptoxyphenyl)carbamate chloride Traditional Name: N-(2-heptoxyphenyl)carbamic acid 2-(2,4-dimethylpiperidin-1-ium-1-yl)ethyl ester chloride Formula: C23H39ClN2O3 MolecularWeight: 427.02036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=CC=C1NC(=O)OCC[NH+]2CCC(CC2C)C.[Cl-]

Isomeric SMILES

CCCCCCCOC1=CC=CC=C1NC(=O)OCC[NH+]2CCC(CC2C)C.[Cl-]

InChI

InChI=1S/C23H38N2O3.ClH/c1-4-5-6-7-10-16-27-22-12-9-8-11-21(22)24-23(26)28-17-15-25-14-13-19(2)18-20(25)3;/h8-9,11-12,19-20H,4-7,10,13-18H2,1-3H3,(H,24,26);1H