Identification
Name |
Celabenzine |
Synonyms |
(2S)-9-(Oxo-Phenylmethyl)-2-Phenyl-1,5,9-Triazacyclotridecan-4-One; (2S)-2-Phenyl-9-Phenylcarbonyl-1,5,9-Triazacyclotridecan-4-One; Celabenzine |
|
Molecular Structure |
 |
Molecular Formula |
C23H29N3O2 |
Molecular Weight |
379.50 |
CAS Registry Number |
53938-08-2 |
SMILES |
[C@@H]1(NCCCCN(CCCNC(=O)C1)C(=O)C2=CC=CC=C2)C3=CC=CC=C3 |
InChI |
1S/C23H29N3O2/c27-22-18-21(19-10-3-1-4-11-19)24-14-7-8-16-26(17-9-15-25-22)23(28)20-12-5-2-6-13-20/h1-6,10-13,21,24H,7-9,14-18H2,(H,25,27)/t21-/m0/s1 |
InChIKey |
LSYKFBZWBDMZLQ-NRFANRHFSA-N |
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