ethyl 1-[3-(2-chloranylphenoxy)propyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[3-(2-chloranylphenoxy)propyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[3-(2-chlorophenoxy)propyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[3-(2-chlorophenoxy)propyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(2-chlorophenoxy)propyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[3-(2-chlorophenoxy)propyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C17H25ClNO3+ MolecularWeight: 326.8383

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)CCCOC2=CC=CC=C2Cl

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)CCCOC2=CC=CC=C2Cl

InChI

InChI=1S/C17H24ClNO3/c1-2-21-17(20)14-8-11-19(12-9-14)10-5-13-22-16-7-4-3-6-15(16)18/h3-4,6-7,14H,2,5,8-13H2,1H3/p+1