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

Systemtic Name: ethyl 1-[2-(3-propan-2-ylphenoxy)ethyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[2-(3-isopropylphenoxy)ethyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[2-(3-propan-2-ylphenoxy)ethyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(3-propan-2-ylphenoxy)ethyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[2-(3-isopropylphenoxy)ethyl]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)CCOC2=CC=CC(=C2)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C19H29NO3/c1-4-22-19(21)16-8-10-20(11-9-16)12-13-23-18-7-5-6-17(14-18)15(2)3/h5-7,14-16H,4,8-13H2,1-3H3/p+1