Products 117811-11-7

CAS 117811-11-7 appears in our catalog under these names: Desloratadine Impurity 17, Desloratadine Impurity 45. Offered by: Chemat Brand. Available pack sizes: on request.

Desloratadine Impurity 17
Chemat Brand
  • size: on request
  • Variants: 1
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Desloratadine Impurity 45
Chemat Brand
  • size: on request
  • Variants: 1
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Structural formula: {0} (CAS {1})

13-chloro-2-piperidin-4-ylidene-4-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-9-one (CAS 117811-11-7) is a chemical compound with the molecular formula C19H17ClN2O and a molecular weight of 324.8 g/mol. IUPAC name: 13-chloro-2-piperidin-4-ylidene-4-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-9-one. InChIKey: VHAKXBCKHLPQOR-UHFFFAOYSA-N.

Identity
Molecular formulaC19H17ClN2O
Molecular weight324.8 g/mol
IUPAC name13-chloro-2-piperidin-4-ylidene-4-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-9-one
InChIKeyVHAKXBCKHLPQOR-UHFFFAOYSA-N
SMILESC1CNCCC1=C2C3=C(CC(=O)C4=C2N=CC=C4)C=C(C=C3)Cl

Computed by PubChem (NCBI)

Synonyms: Desloratadine Impurity 45, VHAKXBCKHLPQOR-UHFFFAOYSA-N
Isomers (same molecular formula)
13-chloro-2-piperidin-4-ylidene-4-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one C19H17ClN2O
7-chloro-1-(cyclopropylmethyl)-5-(2,3,4,5,6-pentadeuteriophenyl)-3H-1,4-benzodiazepin-2-one C19H17ClN2O
6-(2-chlorophenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one C19H17ClN2O