cyclobutyl-[[(3S)-3-oxidanyl-2-oxidanylidene-1-[(4-propan-2-ylphenyl)methyl]piperidin-3-yl]methyl]azanium

Systemtic Name: cyclobutyl-[[(3S)-3-oxidanyl-2-oxidanylidene-1-[(4-propan-2-ylphenyl)methyl]piperidin-3-yl]methyl]azanium Openeye Name: cyclobutyl-[[(3S)-3-hydroxy-1-[(4-isopropylphenyl)methyl]-2-oxo-3-piperidyl]methyl]ammonium CAS Name: cyclobutyl-[[(3S)-3-hydroxy-2-oxo-1-[(4-propan-2-ylphenyl)methyl]-3-piperidinyl]methyl]ammonium IUPAC Name: cyclobutyl-[[(3S)-3-hydroxy-2-oxo-1-[(4-propan-2-ylphenyl)methyl]piperidin-3-yl]methyl]azanium Traditional Name: cyclobutyl-[[(3S)-3-hydroxy-1-(4-isopropylbenzyl)-2-keto-3-piperidyl]methyl]ammonium Formula: C20H31N2O2+ MolecularWeight: 331.47234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN2CCCC(C2=O)(C[NH2+]C3CCC3)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN2CCC[C@@](C2=O)(C[NH2+]C3CCC3)O

InChI

InChI=1S/C20H30N2O2/c1-15(2)17-9-7-16(8-10-17)13-22-12-4-11-20(24,19(22)23)14-21-18-5-3-6-18/h7-10,15,18,21,24H,3-6,11-14H2,1-2H3/p+1/t20-/m0/s1