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(Q83100043)
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English
Carbamic acid, (2-propoxyphenyl)-, 3-(dimethylamino)bicyclo(2.2.2)oct-2-yl ester, monohydrochloride, trans-
group of stereoisomers with the chemical formula C₂₀H₃₁ClN₂O₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
382.20232053200004
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₃₁ClN₂O₃
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CCCOc1ccccc1N=C(O)OC1C2CCC(CC2)C1N(C)C.Cl
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CCCOc1ccccc1N=C(O)O[C@H]1C2CCC(CC2)[C@@H]1N(C)C.Cl
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C20H30N2O3.ClH/c1-4-13-24-17-8-6-5-7-16(17)21-20(23)25-19-15-11-9-14(10-12-15)18(19)22(2)3;/h5-8,14-15,18-19H,4,9-13H2,1-3H3,(H,21,23);1H/t14?,15?,18-,19-;/m0./s1
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InChIKey
QLDHNVFEHBCHSD-PXAFJGETSA-N
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CAS Registry Number
71746-33-3
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PubChem CID
3054760
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
66391921
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID00221970
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DSSTOX compound identifier
DTXCID30144461
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