2,3-dihydro-1H-inden-2-yl-[[(3R)-1-(2,2-dimethylpropyl)-3-oxidanyl-2-oxidanylidene-piperidin-3-yl]methyl]azanium

Systemtic Name: 2,3-dihydro-1H-inden-2-yl-[[(3R)-1-(2,2-dimethylpropyl)-3-oxidanyl-2-oxidanylidene-piperidin-3-yl]methyl]azanium Openeye Name: [(3R)-1-(2,2-dimethylpropyl)-3-hydroxy-2-oxo-3-piperidyl]methyl-indan-2-yl-ammonium CAS Name: 2,3-dihydro-1H-inden-2-yl-[[(3R)-1-(2,2-dimethylpropyl)-3-hydroxy-2-oxo-3-piperidinyl]methyl]ammonium IUPAC Name: 2,3-dihydro-1H-inden-2-yl-[[(3R)-1-(2,2-dimethylpropyl)-3-hydroxy-2-oxopiperidin-3-yl]methyl]azanium Traditional Name: [(3R)-3-hydroxy-2-keto-1-neopentyl-3-piperidyl]methyl-indan-2-yl-ammonium Formula: C20H31N2O2+ MolecularWeight: 331.47234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CN1CCCC(C1=O)(C[NH2+]C2CC3=CC=CC=C3C2)O

Isomeric SMILES

CC(C)(C)CN1CCC[C@](C1=O)(C[NH2+]C2CC3=CC=CC=C3C2)O

InChI

InChI=1S/C20H30N2O2/c1-19(2,3)14-22-10-6-9-20(24,18(22)23)13-21-17-11-15-7-4-5-8-16(15)12-17/h4-5,7-8,17,21,24H,6,9-14H2,1-3H3/p+1/t20-/m1/s1