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

Systemtic Name: ethyl 1-[2-(3-methylphenoxy)ethyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[2-(3-methylphenoxy)ethyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[2-(3-methylphenoxy)ethyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(3-methylphenoxy)ethyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[2-(3-methylphenoxy)ethyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C17H26NO3+ MolecularWeight: 292.39324

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)CCOC2=CC=CC(=C2)C

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)CCOC2=CC=CC(=C2)C

InChI

InChI=1S/C17H25NO3/c1-3-20-17(19)15-7-9-18(10-8-15)11-12-21-16-6-4-5-14(2)13-16/h4-6,13,15H,3,7-12H2,1-2H3/p+1