1-adamantyl-[[(3S)-1-(cyclobutylmethyl)-3-oxidanyl-2-oxidanylidene-piperidin-3-yl]methyl]azanium

Systemtic Name: 1-adamantyl-[[(3S)-1-(cyclobutylmethyl)-3-oxidanyl-2-oxidanylidene-piperidin-3-yl]methyl]azanium Openeye Name: 1-adamantyl-[[(3S)-1-(cyclobutylmethyl)-3-hydroxy-2-oxo-3-piperidyl]methyl]ammonium CAS Name: 1-adamantyl-[[(3S)-1-(cyclobutylmethyl)-3-hydroxy-2-oxo-3-piperidinyl]methyl]ammonium IUPAC Name: 1-adamantyl-[[(3S)-1-(cyclobutylmethyl)-3-hydroxy-2-oxopiperidin-3-yl]methyl]azanium Traditional Name: 1-adamantyl-[[(3S)-1-(cyclobutylmethyl)-3-hydroxy-2-keto-3-piperidyl]methyl]ammonium Formula: C21H35N2O2+ MolecularWeight: 347.5148

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)CN2CCCC(C2=O)(C[NH2+]C34CC5CC(C3)CC(C5)C4)O

Isomeric SMILES

C1CC(C1)CN2CCC[C@@](C2=O)(C[NH2+]C34CC5CC(C3)CC(C5)C4)O

InChI

InChI=1S/C21H34N2O2/c24-19-21(25,5-2-6-23(19)13-15-3-1-4-15)14-22-20-10-16-7-17(11-20)9-18(8-16)12-20/h15-18,22,25H,1-14H2/p+1/t16?,17?,18?,20?,21-/m0/s1