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Substance Name: 5H-Pyrrolo(2,1-c)(1,4)benzodiazepin-5-one, 1,2,3,11a-tetrahydro-7-methoxy-8-(phenylmethoxy)-,(R)-
RN: 116564-97-7
InChIKey: PXXBSLZVZRNTAD-OAHLLOKOSA-N

Molecular Formula

  • C20-H20-N2-O3

Molecular Weight

  • 336.389
 
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Names and Synonyms

Synonym

  • BRN 3562593

Systematic Name

  • 5H-Pyrrolo(2,1-c)(1,4)benzodiazepin-5-one, 1,2,3,11a-tetrahydro-7-methoxy-8-(phenylmethoxy)-,(R)-

Registry Numbers

CAS Registry Number

  • 116564-97-7

System Generated Number

  • 0116564977

Structure Descriptors

InChI

1S/C20H20N2O3/c1-24-18-10-16-17(21-12-15-8-5-9-22(15)20(16)23)11-19(18)25-13-14-6-3-2-4-7-14/h2-4,6-7,10-12,15H,5,8-9,13H2,1H3/t15-/m1/s1

InChIKey

PXXBSLZVZRNTAD-OAHLLOKOSA-N

Smiles

COc1cc2c(cc1OCc3ccccc3)N=C[C@H]4CCCN4C2=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 100mg/kg (100mg/kg)   Chemical Research in Toxicology. Vol. 1, Pg. 258, 1988.