(1-methylpiperidin-1-ium-4-yl) 4-ethoxybenzoate chloride

Systemtic Name: (1-methylpiperidin-1-ium-4-yl) 4-ethoxybenzoate chloride Openeye Name: (1-methylpiperidin-1-ium-4-yl) 4-ethoxybenzoate chloride CAS Name: 4-ethoxybenzoic acid (1-methyl-4-piperidin-1-iumyl) ester chloride IUPAC Name: (1-methylpiperidin-1-ium-4-yl) 4-ethoxybenzoate chloride Traditional Name: 4-ethoxybenzoic acid (1-methylpiperidin-1-ium-4-yl) ester chloride Formula: C15H22ClNO3 MolecularWeight: 299.79308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)OC2CC[NH+](CC2)C.[Cl-]

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)OC2CC[NH+](CC2)C.[Cl-]

InChI

InChI=1S/C15H21NO3.ClH/c1-3-18-13-6-4-12(5-7-13)15(17)19-14-8-10-16(2)11-9-14;/h4-7,14H,3,8-11H2,1-2H3;1H