Basic Information |
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Product Name: | BENZENEETHANAMINE, 2,5-DIMETHOXY-4-(PENTYLTHIO)-, (Z)-2-BUTENEDIOATE (1:1) |
CAS: | 129658-10-2 |
English Synonyms: | BENZENEETHANAMINE, 2,5-DIMETHOXY-4-(PENTYLTHIO)-, (Z)-2-BUTENEDIOATE (1:1) |
MDL Number.: | MFCD01657184 |
H bond acceptor: | 3 |
H bond donor: | 1 |
Smile: | CCCCCSc1cc(c(cc1OC)CCN)OC.C(=C\C(=O)O)\C(=O)O |
InChi: | InChI=1S/C15H25NO2S.C4H4O4/c1-4-5-6-9-19-15-11-13(17-2)12(7-8-16)10-14(15)18-3;5-3(6)1-2-4(7)8/h10-11H,4-9,16H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1- |
InChiKey: | InChIKey=BUIMMXSYSWNWBW-BTJKTKAUSA-N |
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