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Substance Name: 4-((5-((1-(4'-(Hexadecyloxy)-3,6-dihydroxy-5-methyl(1,1'-biphenyl)-2-yl)ethyl)sulphonyl)-2-methoxyphenyl)azo)-2,4-dihydro-5-methyl-2-phenyl-3H-pyrazol-3-one
RN: 84304-19-8
InChIKey: QCDCGFUCERJMNZ-BNEIJSFPSA-N

Molecular Formula

  • C48-H62-N4-O7-S

Molecular Weight

  • 839.1048
 
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Names and Synonyms

Synonym

  • EINECS 282-705-5

Systematic Name

  • 4-((5-((1-(4'-(Hexadecyloxy)-3,6-dihydroxy-5-methyl(1,1'-biphenyl)-2-yl)ethyl)sulphonyl)-2-methoxyphenyl)azo)-2,4-dihydro-5-methyl-2-phenyl-3H-pyrazol-3-one

Registry Numbers

CAS Registry Number

  • 84304-19-8

System Generated Number

  • 0084304198

Structure Descriptors

InChI

1S/C48H62N4O7S/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-22-31-59-39-27-25-37(26-28-39)45-44(42(53)32-34(2)47(45)54)36(4)60(56,57)40-29-30-43(58-5)41(33-40)49-50-46-35(3)51-52(48(46)55)38-23-20-19-21-24-38/h19-21,23-30,32-33,36,46,53-54H,6-18,22,31H2,1-5H3/b50-49+

InChIKey

QCDCGFUCERJMNZ-BNEIJSFPSA-N

Smiles

CCCCCCCCCCCCCCCCOc1ccc(cc1)c2c(c(cc(c2O)C)O)C(C)S(=O)(=O)c3ccc(c(c3)/N=N/C4C(=NN(C4=O)c5ccccc5)C)OC