Basic Information |
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Product Name: | (1S,2R)-1-(3,4-DIMETHOXYBENZYL)-2-(3-(5-(3-((1R,2R)-1-(3,4-DIMETHOXYBENZYL)-6,7-DIMETHOXY-2-METHYL-1,2,3,4-TETRAHYDROISOQUINOLINIUM-2-YL)PROPANOYLOXY)PENTYLOXY)-3-OXOPROPYL)-6,7-DIMETHOXY-2-METHYL-1,2,3,4-TETRAHYDROISOQUINOLINIUM BENZENESULFONATE |
CAS: | 96946-42-8 |
English Synonyms: | (1S,2R)-1-(3,4-DIMETHOXYBENZYL)-2-(3-(5-(3-((1R,2R)-1-(3,4-DIMETHOXYBENZYL)-6,7-DIMETHOXY-2-METHYL-1,2,3,4-TETRAHYDROISOQUINOLINIUM-2-YL)PROPANOYLOXY)PENTYLOXY)-3-OXOPROPYL)-6,7-DIMETHOXY-2-METHYL-1,2,3,4-TETRAHYDROISOQUINOLINIUM BENZENESULFONATE ; ATRACURIUM BESYLATE ; CISATRACURIUM (BESYLATE) |
MDL Number.: | MFCD12912683 |
H bond acceptor: | 14 |
H bond donor: | 0 |
Smile: | Cc1ccc(cc1)S(=O)(=O)[O-].Cc1ccc(cc1)S(=O)(=O)[O-].C[N@@+]1(CCc2cc(c(cc2[C@H]1Cc3ccc(c(c3)OC)OC)OC)OC)CCC(=O)OCCCCCOC(=O)CC[N@+]4(CCc5cc(c(cc5[C@@H]4Cc6ccc(c(c6)OC)OC)OC)OC)C |
InChi: | InChI=1S/C53H72N2O12.2C7H8O3S/c1-54(22-18-38-32-48(62-7)50(64-9)34-40(38)42(54)28-36-14-16-44(58-3)46(30-36)60-5)24-20-52(56)66-26-12-11-13-27-67-53(57)21-25-55(2)23-19-39-33-49(63-8)51(65-10)35-41(39)43(55)29-37-15-17-45(59-4)47(31-37)61-6;2*1-6-2-4-7(5-3-6)11(8,9)10/h14-17,30-35,42-43H,11-13,18-29H2,1-10H3;2*2-5H,1H3,(H,8,9,10)/q+2;;/p-2/t42-,43+,54-,55-;;/m1../s1 |
InChiKey: | InChIKey=OPIVMDCYJDIKDQ-NVYWYWNDSA-L |
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