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(Q82524493)
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English
tert-Butyl {4-[(isoquinolin-5-yl)amino]butyl}carbamate
chemical compound
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Statements
instance of
type of chemical entity
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subclass of
chemical compound
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mass
315.4107
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₈H₂₅N₃O₂
0 references
canonical SMILES
CC(C)(C)OC(=O)NCCCCNC1=CC=CC2=C1C=CN=C2
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Identifiers
InChI
InChI=1S/C18H25N3O2/c1-18(2,3)23-17(22)21-11-5-4-10-20-16-8-6-7-14-13-19-12-9-15(14)16/h6-9,12-13,20H,4-5,10-11H2,1-3H3,(H,21,22)
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InChIKey
DRKAJZSMFQWVAV-UHFFFAOYSA-N
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CAS Registry Number
651309-92-1
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PubChem CID
21979821
1 reference
matched by identifier from
InChIKey
InChIKey
DRKAJZSMFQWVAV-UHFFFAOYSA-N
UniChem compound ID
30460816
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID50621082
1 reference
matched by identifier from
InChIKey
InChIKey
DRKAJZSMFQWVAV-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID50571836
0 references
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