cyclohexyl-[[(3S)-3-oxidanyl-2-oxidanylidene-1-phenethyl-piperidin-3-yl]methyl]azanium

Systemtic Name: cyclohexyl-[[(3S)-3-oxidanyl-2-oxidanylidene-1-phenethyl-piperidin-3-yl]methyl]azanium Openeye Name: cyclohexyl-[[(3S)-3-hydroxy-2-oxo-1-phenethyl-3-piperidyl]methyl]ammonium CAS Name: cyclohexyl-[[(3S)-3-hydroxy-2-oxo-1-phenethyl-3-piperidinyl]methyl]ammonium IUPAC Name: cyclohexyl-[[(3S)-3-hydroxy-2-oxo-1-phenethylpiperidin-3-yl]methyl]azanium Traditional Name: cyclohexyl-[[(3S)-3-hydroxy-2-keto-1-phenethyl-3-piperidyl]methyl]ammonium Formula: C20H31N2O2+ MolecularWeight: 331.47234

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH2+]CC2(CCCN(C2=O)CCC3=CC=CC=C3)O

Isomeric SMILES

C1CCC(CC1)[NH2+]C[C@]2(CCCN(C2=O)CCC3=CC=CC=C3)O

InChI

InChI=1S/C20H30N2O2/c23-19-20(24,16-21-18-10-5-2-6-11-18)13-7-14-22(19)15-12-17-8-3-1-4-9-17/h1,3-4,8-9,18,21,24H,2,5-7,10-16H2/p+1/t20-/m0/s1