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CHEBI:49451 - 18-CHLORO-11,12,13,14-TETRAHYDRO-1H,10H-8,4-(AZENO)-9,15,1,3,6-BENZODIOXATRIAZACYCLOHEPTADECIN-2-ONE

Default Structure
ChEBI IDCHEBI:49451
ChEBI Name18-CHLORO-11,12,13,14-TETRAHYDRO-1H,10H-8,4-(AZENO)-9,15,1,3,6-BENZODIOXATRIAZACYCLOHEPTADECIN-2-ONE
Stars
Last Modified17 October 2009
DownloadsMolfile
FormulaC16H17ClN4O3
Net Charge0
Average Mass348.790
Monoisotopic Mass348.09892
SMILES[H]c1nc([H])c2nc1OC([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])Oc1c([H])c([H])c(Cl)c([H])c1N([H])C(=O)N2[H]
InChIInChI=1S/C16H17ClN4O3/c17-11-4-5-13-12(8-11)19-16(22)21-14-9-18-10-15(20-14)24-7-3-1-2-6-23-13/h4-5,8-10H,1-3,6-7H2,(H2,19,20,21,22)
InChIKeyJRSWWYITYIOHOP-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
18-CHLORO-11,12,13,14-TETRAHYDRO-1H,10H-8,4-(AZENO)-9,15,1,3,6-BENZODIOXATRIAZACYCLOHEPTADECIN-2-ONE (CHEBI:49451) is a unclassifieds (CHEBI:27189)
Synonyms  Source
18-chloro-11,12,13,14-tetrahydro-1H,10H-8,4-(azeno)-9,15,1,3,6-benzodioxatriazacycloheptadecin-2(3H)-onePDBeChem
18-CHLORO-11,12,13,14-TETRAHYDRO-1H,10H-8,4-(AZENO)-9,15,1,3,6-BENZODIOXATRIAZACYCLOHEPTADECIN-2-ONEPDBeChem
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A25PDBeChem