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

Systemtic Name: ethyl 1-[3-(2-methylphenoxy)propyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[3-(2-methylphenoxy)propyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[3-(2-methylphenoxy)propyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(2-methylphenoxy)propyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[3-(2-methylphenoxy)propyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C18H28NO3+ MolecularWeight: 306.41982

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)CCCOC2=CC=CC=C2C

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)CCCOC2=CC=CC=C2C

InChI

InChI=1S/C18H27NO3/c1-3-21-18(20)16-9-12-19(13-10-16)11-6-14-22-17-8-5-4-7-15(17)2/h4-5,7-8,16H,3,6,9-14H2,1-2H3/p+1