537-05-3
茴胍卡因
Name
茴胍卡因
pro_formula
C23 H25 N3 O3 . Cl H
pro_molWeight
427.929
1Identification
【Name】
茴胍卡因
【CAS】
【MDL】
MFCD01724110
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C23 H25 N3 O3 . Cl H
【pro_molWeight】
427.929
【Inchi】
InChI=1S/C23H25N3O3.ClH/c1-4-29-22-15-9-19(10-16-22)26-23(24-17-5-11-20(27-2)12-6-17)25-18-7-13-21(28-3)14-8-18;/h5-16H,4H2,1-3H3,(H2,24,25,26);1H
【InChIKey】
InChIKey=ZQWBGSZBBGYKNV-UHFFFAOYSA-N
【SMILES】
CCOc1ccc(cc1)N=C(Nc2ccc(cc2)OC)Nc3ccc(cc3)OC.Cl
【MOL File】
2ChemicalProperties
【ComputedProperties】
pro_donors:2
pro_acceptors:6
XLogP3:0.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
茴胍卡因.cml
quick_release
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