2-[(3R,4S)-1-cyclobutylcarbonyl-3-(2-morpholin-4-ium-4-ylethyl)piperidin-4-yl]ethanoate

Systemtic Name: 2-[(3R,4S)-1-cyclobutylcarbonyl-3-(2-morpholin-4-ium-4-ylethyl)piperidin-4-yl]ethanoate Openeye Name: 2-[(3R,4S)-1-(cyclobutanecarbonyl)-3-(2-morpholin-4-ium-4-ylethyl)-4-piperidyl]acetate CAS Name: 2-[(3R,4S)-1-[cyclobutyl(oxo)methyl]-3-[2-(4-morpholin-4-iumyl)ethyl]-4-piperidinyl]acetate IUPAC Name: 2-[(3R,4S)-1-(cyclobutanecarbonyl)-3-(2-morpholin-4-ium-4-ylethyl)piperidin-4-yl]acetate Traditional Name: 2-[(3R,4S)-1-(cyclobutanecarbonyl)-3-(2-morpholin-4-ium-4-ylethyl)-4-piperidyl]acetate Formula: C18H30N2O4 MolecularWeight: 338.4418

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(=O)N2CCC(C(C2)CC[NH+]3CCOCC3)CC(=O)[O-]

Isomeric SMILES

C1CC(C1)C(=O)N2CC[C@H]([C@H](C2)CC[NH+]3CCOCC3)CC(=O)[O-]

InChI

InChI=1S/C18H30N2O4/c21-17(22)12-15-5-7-20(18(23)14-2-1-3-14)13-16(15)4-6-19-8-10-24-11-9-19/h14-16H,1-13H2,(H,21,22)/t15-,16-/m0/s1