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

Systemtic Name: 2-[(3R,4S)-1-cyclohexylcarbonyl-3-(2-morpholin-4-ium-4-ylethyl)piperidin-4-yl]ethanoate Openeye Name: 2-[(3R,4S)-1-(cyclohexanecarbonyl)-3-(2-morpholin-4-ium-4-ylethyl)-4-piperidyl]acetate CAS Name: 2-[(3R,4S)-1-[cyclohexyl(oxo)methyl]-3-[2-(4-morpholin-4-iumyl)ethyl]-4-piperidinyl]acetate IUPAC Name: 2-[(3R,4S)-1-(cyclohexanecarbonyl)-3-(2-morpholin-4-ium-4-ylethyl)piperidin-4-yl]acetate Traditional Name: 2-[(3R,4S)-1-(cyclohexanecarbonyl)-3-(2-morpholin-4-ium-4-ylethyl)-4-piperidyl]acetate Formula: C20H34N2O4 MolecularWeight: 366.49496

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N2CCC(C(C2)CC[NH+]3CCOCC3)CC(=O)[O-]

Isomeric SMILES

C1CCC(CC1)C(=O)N2CC[C@H]([C@H](C2)CC[NH+]3CCOCC3)CC(=O)[O-]

InChI

InChI=1S/C20H34N2O4/c23-19(24)14-17-7-9-22(20(25)16-4-2-1-3-5-16)15-18(17)6-8-21-10-12-26-13-11-21/h16-18H,1-15H2,(H,23,24)/t17-,18-/m0/s1