Basic Information |
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| Product Name: | 1-(3-SULFO-4-PHENOXY-PHENYL)-3-OCTADECANAMIDO-4-[(4-TOLYSULFONAMIDO)-PHENYLAZO]-5-PYRAZOLINE-5-ONE |
| CAS: | 55695-83-5 |
| English Synonyms: | 1-(3-SULFO-4-PHENOXY-PHENYL)-3-OCTADECANAMIDO-4-[(4-TOLYSULFONAMIDO)-PHENYLAZO]-5-PYRAZOLINE-5-ONE |
| MDL Number.: | MFCD00142538 |
| H bond acceptor: | 14 |
| H bond donor: | 3 |
| Smile: | CCCCCCCCCCCCCCCCCC(=O)NC1=NN(C(=O)C1/N=N/c2ccc(cc2)NS(=O)(=O)c3ccc(cc3)C)c4ccc(c(c4)S(=O)(=O)O)Oc5ccccc5 |
| InChi: | InChI=1S/C46H58N6O8S2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-43(53)47-45-44(49-48-36-26-28-37(29-27-36)51-61(55,56)40-31-24-35(2)25-32-40)46(54)52(50-45)38-30-33-41(42(34-38)62(57,58)59)60-39-21-18-17-19-22-39/h17-19,21-22,24-34,44,51H,3-16,20,23H2,1-2H3,(H,47,50,53)(H,57,58,59)/b49-48+ |
| InChiKey: | InChIKey=IDHHQYWZTKHXQT-DSIMXMMZSA-N |
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