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CHEBI:232744 - RTI-112

Default Structure
ChEBI IDCHEBI:232744
ChEBI NameRTI-112
Stars
SubmitterFlyBase
DownloadsMolfile
FormulaC17H22ClNO2
Net Charge0
Average Mass307.821
Monoisotopic Mass307.13391
SMILES[H]C12CCC([H])(N1C)[C@@]([H])(C(=O)OC)[C@@]([H])(c1ccc(Cl)c(C)c1)C2
InChIInChI=1S/C17H22ClNO2/c1-10-8-11(4-6-14(10)18)13-9-12-5-7-15(19(12)2)16(13)17(20)21-3/h4,6,8,12-13,15-16H,5,7,9H2,1-3H3/t12?,13-,15?,16+/m1/s1
InChIKeyVMITZEMDDZVHBZ-FYAIKVRKSA-N
ChEBI Ontology
Outgoing Relation(s)
RTI-112 (CHEBI:232744) is a organic molecular entity (CHEBI:50860)
IUPAC Name 
methyl (2S,3S)-3-(4-chloro-3-methylphenyl)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate
Registry NumbersSources
CAS:143982-09-6SUBMITTER
Citations