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(Q82918151)
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English
3a,8-Dimethyl-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indol-5-yl hydrogen methylcarbonimidate
group of stereoisomers with the chemical formula C₁₄H₁₉N₃O₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
261.147726848
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₄H₁₉N₃O₂
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CN=C(O)Oc1ccc2c(c1)C1(C)CCNC1N2C
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CNC(=O)Oc1ccc2c(c1)[C@]1(C)CCNC1N2C
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C14H19N3O2/c1-14-6-7-16-12(14)17(3)11-5-4-9(8-10(11)14)19-13(18)15-2/h4-5,8,12,16H,6-7H2,1-3H3,(H,15,18)/t12?,14-/m0/s1
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InChIKey
DWMBEPKCENULIA-PYMCNQPYSA-N
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CAS Registry Number
19573-10-5
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PubChem CID
3084319
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
482673
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID80941346
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DSSTOX compound identifier
DTXCID601369786
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