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Substance Name: Dibenzo(a,e)cycloheptatrien-5-ol, 2-methoxy-1-pyrrolidinylmethyl-
RN: 42981-91-9
InChIKey: IRUJZLPOZJUYPK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H23-N-O2

Molecular Weight

  • 321.418
 
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Names and Synonyms

Synonym

  • 2-Methoxy-1-pyrrolidinylmethyldibenzo(a,e)cycloheptatrien-5-ol

Systematic Name

  • Dibenzo(a,e)cycloheptatrien-5-ol, 2-methoxy-1-pyrrolidinylmethyl-

Registry Numbers

CAS Registry Number

  • 42981-91-9

System Generated Number

  • 0042981919

Structure Descriptors

InChI

1S/C21H23NO2/c1-24-20-11-10-18-17(19(20)14-22-12-4-5-13-22)9-8-15-6-2-3-7-16(15)21(18)23/h2-3,6-11,21,23H,4-5,12-14H2,1H3

InChIKey

IRUJZLPOZJUYPK-UHFFFAOYSA-N

Smiles

c12c([C@@H](c3c(C=C1)cccc3)O)ccc(c2CN1CCCC1)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 15mg/kg (15mg/kg)   Chimica Therapeutica. Vol. 8, Pg. 53, 1973.