ethyl 3-phenylpiperidin-1-ium-4-carboxylate chloride

Systemtic Name: ethyl 3-phenylpiperidin-1-ium-4-carboxylate chloride Openeye Name: ethyl 3-phenylpiperidin-1-ium-4-carboxylate chloride CAS Name: 3-phenyl-4-piperidin-1-iumcarboxylic acid ethyl ester chloride IUPAC Name: ethyl 3-phenylpiperidin-1-ium-4-carboxylate chloride Traditional Name: 3-phenylpiperidin-1-ium-4-carboxylic acid ethyl ester chloride Formula: C14H20ClNO2 MolecularWeight: 269.7671

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH2+]CC1C2=CC=CC=C2.[Cl-]

Isomeric SMILES

CCOC(=O)C1CC[NH2+]CC1C2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C14H19NO2.ClH/c1-2-17-14(16)12-8-9-15-10-13(12)11-6-4-3-5-7-11;/h3-7,12-13,15H,2,8-10H2,1H3;1H