Try beta.chemspider
- Charge
- 2 of 2 defined stereocentres
1-[4-({4-[(4R,5R)-3,3-Dibutyl-7-(dimethylamino)-4-hydroxy-1,1-dioxido-2,3,4,5-tetrahydro-1-benzothiepin-5-yl]phenoxy}methyl)benzyl]-4-aza-1-azoniabicyclo[2.2.2]octane chloride
[Cl-].CN(C)C1C=CC2=C(C=1)[C@H]([C@@H](O)C(CS2(=O)=O)(CCCC)CCCC)C1C=CC(=CC=1)OCC1C=CC(C[N+]23CCN(CC2)CC3)=CC=1
InChI=1S/C40H56N3O4S.ClH/c1-5-7-19-40(20-8-6-2)30-48(45,46)37-18-15-34(41(3)4)27-36(37)38(39(40)44)33-13-16-35(17-14-33)47-29-32-11-9-31(10-12-32)28-43-24-21-42(22-25-43)23-26-43;/h9-18,27,38-39,44H,5-8,19-26,28-30H2,1-4H3;1H/q+1;/p-1/t38-,39-;/m1./s1
POMVPJBWDDJCMP-RUKDTIIFSA-M
CSID:8007374, http://www.chemspider.com/Chemical-Structure.8007374.html (accessed 18:05, May 21, 2024)
Validated by Experts, Validated by Users, Non-Validated, Removed by Users
Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00
No predicted properties have been calculated for this compound.
Click to predict properties on the Chemicalize site
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