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

Systemtic Name: ethyl 1-[4-(3-methylphenoxy)butyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[4-(3-methylphenoxy)butyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[4-(3-methylphenoxy)butyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-(3-methylphenoxy)butyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[4-(3-methylphenoxy)butyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C19H30NO3+ MolecularWeight: 320.4464

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)CCCCOC2=CC=CC(=C2)C

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)CCCCOC2=CC=CC(=C2)C

InChI

InChI=1S/C19H29NO3/c1-3-22-19(21)17-9-12-20(13-10-17)11-4-5-14-23-18-8-6-7-16(2)15-18/h6-8,15,17H,3-5,9-14H2,1-2H3/p+1