ethyl 1-[(2S)-3-cyclohexyloxy-2-oxidanyl-propyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[(2S)-3-cyclohexyloxy-2-oxidanyl-propyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[(2S)-3-(cyclohexoxy)-2-hydroxy-propyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[(2S)-3-cyclohexyloxy-2-hydroxypropyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(2S)-3-cyclohexyloxy-2-hydroxypropyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[(2S)-3-(cyclohexoxy)-2-hydroxy-propyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C17H32NO4+ MolecularWeight: 314.44028

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)CC(COC2CCCCC2)O

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)C[C@@H](COC2CCCCC2)O

InChI

InChI=1S/C17H31NO4/c1-2-21-17(20)14-8-10-18(11-9-14)12-15(19)13-22-16-6-4-3-5-7-16/h14-16,19H,2-13H2,1H3/p+1/t15-/m0/s1