CAS Registry Number®
156679-41-3
CAS Name
DDABDT
Molecular Formula
C26H48N3O.C7H7O3S
Other Names and Identifiers
InChI
InChI=1S/C26H47N3O.C7H8O3S/c1-6-7-8-9-10-11-12-13-14-15-22-29(4,5)23-16-21-27-26(30)24-17-19-25(20-18-24)28(2)3;1-6-2-4-7(5-3-6)11(8,9)10/h17-20H,6-16,21-23H2,1-5H3;2-5H,1H3,(H,8,9,10)
InChIKey
InChIKey=RLPAVRZVJNPKLX-UHFFFAOYSA-N
SMILES
S(=O)(=O)([O-])C1=CC=C(C)C=C1.C(NCCC[N+](CCCCCCCCCCCC)(C)C)(=O)C1=CC=C(N(C)C)C=C1
Canonical SMILES
O=C(NCCC[N+](C)(C)CCCCCCCCCCCC)C1=CC=C(C=C1)N(C)C.O=S(=O)([O-])C1=CC=C(C=C1)C
Other Names for this Substance
- 1-Dodecanaminium, N-[3-[[4-(dimethylamino)benzoyl]amino]propyl]-N,N-dimethyl-, 4-methylbenzenesulfonate (1:1)
- 1-Dodecanaminium, N-[3-[[4-(dimethylamino)benzoyl]amino]propyl]-N,N-dimethyl-, salt with 4-methylbenzenesulfonic acid (1:1)
- Escalol HP 610
- DDABDT
- Escalol HP
