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(Q76854638)
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English
(1R,5S)-N-[2-amino-5-(4-fluorophenyl)phenyl]-8-oxabicyclo[3.2.1]octane-3-carboxamide
chemical compound
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
340.1587061320001
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₂₀H₂₁FN₂O₂
0 references
canonical SMILES
Nc1ccc(-c2ccc(F)cc2)cc1NC(=O)C1CC2CCC(C1)O2
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C1C[C@H]2CC(C[C@@H]1O2)C(=O)NC3=C(C=CC(=C3)C4=CC=C(C=C4)F)N
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Identifiers
InChI
InChI=1S/C20H21FN2O2/c21-15-4-1-12(2-5-15)13-3-8-18(22)19(11-13)23-20(24)14-9-16-6-7-17(10-14)25-16/h1-5,8,11,14,16-17H,6-7,9-10,22H2,(H,23,24)/t14?,16-,17+
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InChIKey
SBKJRDAJADZOCH-ZXFUBFMLSA-N
0 references
PubChem CID
121499152
0 references
UniChem compound ID
147884021
1 reference
stated in
UniChem
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