tert-butyl (2S)-2-(4-piperidin-1-ium-1-ylpiperidin-1-yl)-4-oxa-8-azaspiro[4.5]decane-8-carboxylate

Systemtic Name: tert-butyl (2S)-2-(4-piperidin-1-ium-1-ylpiperidin-1-yl)-4-oxa-8-azaspiro[4.5]decane-8-carboxylate Openeye Name: tert-butyl (2S)-2-(4-piperidin-1-ium-1-yl-1-piperidyl)-4-oxa-8-azaspiro[4.5]decane-8-carboxylate CAS Name: (2S)-2-[4-(1-piperidin-1-iumyl)-1-piperidinyl]-4-oxa-8-azaspiro[4.5]decane-8-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-(4-piperidin-1-ium-1-ylpiperidin-1-yl)-4-oxa-8-azaspiro[4.5]decane-8-carboxylate Traditional Name: (2S)-2-(4-piperidin-1-ium-1-ylpiperidino)-4-oxa-8-azaspiro[4.5]decane-8-carboxylic acid tert-butyl ester Formula: C23H42N3O3+ MolecularWeight: 408.59788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2(CC1)CC(CO2)N3CCC(CC3)[NH+]4CCCCC4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H](CO2)N3CCC(CC3)[NH+]4CCCCC4

InChI

InChI=1S/C23H41N3O3/c1-22(2,3)29-21(27)26-15-9-23(10-16-26)17-20(18-28-23)25-13-7-19(8-14-25)24-11-5-4-6-12-24/h19-20H,4-18H2,1-3H3/p+1/t20-/m0/s1