3-(2-methylpiperidin-1-ium-1-yl)propyl 2-phenoxyethanoate chloride

Systemtic Name: 3-(2-methylpiperidin-1-ium-1-yl)propyl 2-phenoxyethanoate chloride Openeye Name: 3-(2-methylpiperidin-1-ium-1-yl)propyl 2-phenoxyacetate chloride CAS Name: 2-phenoxyacetic acid 3-(2-methyl-1-piperidin-1-iumyl)propyl ester chloride IUPAC Name: 3-(2-methylpiperidin-1-ium-1-yl)propyl 2-phenoxyacetate chloride Traditional Name: 2-phenoxyacetic acid 3-(2-methylpiperidin-1-ium-1-yl)propyl ester chloride Formula: C17H26ClNO3 MolecularWeight: 327.84624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCOC(=O)COC2=CC=CC=C2.[Cl-]

Isomeric SMILES

CC1CCCC[NH+]1CCCOC(=O)COC2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C17H25NO3.ClH/c1-15-8-5-6-11-18(15)12-7-13-20-17(19)14-21-16-9-3-2-4-10-16;/h2-4,9-10,15H,5-8,11-14H2,1H3;1H