5-(4-((E)-[4-(ACETYLAMINO)PHENYL]DIAZENYL)-3-HEPTADECYL-5-OXO-4,5-DIHYDRO-1H-PYRAZOL-1-YL)-2-PHENOXYBENZENESULFONIC ACID

pro_cas
97734-34-4
pro_cdbregno
CCD00322675
pro_formula
C40 H53 N5 O6 S
pro_molWeight
731.954

basic_info

Product_Name: 5-(4-((E)-[4-(ACETYLAMINO)PHENYL]DIAZENYL)-3-HEPTADECYL-5-OXO-4,5-DIHYDRO-1H-PYRAZOL-1-YL)-2-PHENOXYBENZENESULFONIC ACID
CAS: 97734-34-4
EnglishSynonyms: 5-(4-((E)-[4-(ACETYLAMINO)PHENYL]DIAZENYL)-3-HEPTADECYL-5-OXO-4,5-DIHYDRO-1H-PYRAZOL-1-YL)-2-PHENOXYBENZENESULFONIC ACID
pro_mdlNumber: MFCD02602386
pro_acceptors: 11
pro_donors: 2
pro_smile: CCCCCCCCCCCCCCCCCC1=NN(C(=O)C1/N=N/c2ccc(cc2)NC(=O)C)c3ccc(c(c3)S(=O)(=O)O)Oc4ccccc4
InChi: InChI=1S/C40H53N5O6S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-36-39(43-42-33-26-24-32(25-27-33)41-31(2)46)40(47)45(44-36)34-28-29-37(38(30-34)52(48,49)50)51-35-21-18-17-19-22-35/h17-19,21-22,24-30,39H,3-16,20,23H2,1-2H3,(H,41,46)(H,48,49,50)/b43-42+
InChiKey: InChIKey=LLOCQSSHYTUGSW-HBSCQBRPSA-N

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