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English
tert-Butyl hydrogen [2-methyl-1-(5-methyl-4-oxo-4H-3,1-benzoxazin-2-yl)propyl]carbonimidate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
332.173607248
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₈H₂₄N₂O₄
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canonical SMILES
Cc1cccc2nc(C(NC(=O)OC(C)(C)C)C(C)C)oc(=O)c12
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CC1=C2C(=CC=C1)N=C(OC2=O)[C@H](C(C)C)NC(=O)OC(C)(C)C
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Identifiers
InChI
InChI=1S/C18H24N2O4/c1-10(2)14(20-17(22)24-18(4,5)6)15-19-12-9-7-8-11(3)13(12)16(21)23-15/h7-10,14H,1-6H3,(H,20,22)/t14-/m0/s1
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InChIKey
VSYABKQYUKTACZ-AWEZNQCLSA-N
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CAS Registry Number
108562-42-1
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PubChem CID
194787
1 reference
matched by identifier from
InChIKey
InChIKey
VSYABKQYUKTACZ-AWEZNQCLSA-N
UniChem compound ID
26137627
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID80910774
1 reference
matched by identifier from
InChIKey
InChIKey
VSYABKQYUKTACZ-AWEZNQCLSA-N
DSSTOX compound identifier
DTXCID401339818
0 references
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