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English
(R)-TERT-BUTYL 4-BENZYL-2-METHYLPIPERAZINE-1-CARBOXYLATE
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
290.199428072
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
stereoisomer of
(S)-1-tert-butoxycarbonyl-2-methyl-4-benzylpiperazine
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₇H₂₆N₂O₂
0 references
canonical SMILES
CC1CN(Cc2ccccc2)CCN1C(=O)OC(C)(C)C
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C[C@@H]1CN(CCN1C(=O)OC(C)(C)C)CC2=CC=CC=C2
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Identifiers
InChI
InChI=1S/C17H26N2O2/c1-14-12-18(13-15-8-6-5-7-9-15)10-11-19(14)16(20)21-17(2,3)4/h5-9,14H,10-13H2,1-4H3/t14-/m1/s1
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InChIKey
ZPDZNQZBTLCTDV-CQSZACIVSA-N
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CAS Registry Number
170033-58-6
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PubChem CID
10085634
1 reference
matched by identifier from
InChIKey
InChIKey
ZPDZNQZBTLCTDV-CQSZACIVSA-N
UniChem compound ID
20393406
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40435438
1 reference
matched by identifier from
InChIKey
InChIKey
ZPDZNQZBTLCTDV-CQSZACIVSA-N
DSSTOX compound identifier
DTXCID90386264
0 references
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