Basic Information |
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Product Name: | OCTIMIBATE |
CAS: | 89838-96-0 |
English Synonyms: | OCTIMIBATE |
MDL Number.: | MFCD00865762 |
H bond acceptor: | 5 |
H bond donor: | 1 |
Smile: | c1ccc(cc1)c2c(n(c(n2)OCCCCCCCC(=O)O)c3ccccc3)c4ccccc4 |
InChi: | InChI=1S/C29H30N2O3/c32-26(33)21-13-2-1-3-14-22-34-29-30-27(23-15-7-4-8-16-23)28(24-17-9-5-10-18-24)31(29)25-19-11-6-12-20-25/h4-12,15-20H,1-3,13-14,21-22H2,(H,32,33) |
InChiKey: | InChIKey=JJNUVQIGQRFZAC-UHFFFAOYSA-N |
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