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Substance Name: 1-Naphthaleneacetaldehyde, alpha-(2-(dimethylamino)ethyl)-alpha-isobutyl-
RN: 30120-98-0
InChIKey: VLGICAFBZSZMJF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H27-N-O

Molecular Weight

  • 297.439
 
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Names and Synonyms

Synonyms

  • alpha-(2-(Dimethylamino)ethyl)-alpha-isobutyl-1-naphthaleneacetaldehyde
  • BRN 2140632
  • NSC 171387

Systematic Names

  • 1-Naphthaleneacetaldehyde, alpha-(2-(dimethylamino)ethyl)-alpha-(2-methylpropyl)- (9CI)
  • 1-Naphthaleneacetaldehyde, alpha-(2-(dimethylamino)ethyl)-alpha-isobutyl-

Registry Numbers

CAS Registry Number

  • 30120-98-0

System Generated Number

  • 0030120980

Structure Descriptors

InChI

1S/C20H27NO/c1-16(2)14-20(15-22,12-13-21(3)4)19-11-7-9-17-8-5-6-10-18(17)19/h5-11,15-16H,12-14H2,1-4H3

InChIKey

VLGICAFBZSZMJF-UHFFFAOYSA-N

Smiles

c1([C@@](CC(C)C)(CCN(C)C)C=O)c2c(cccc2)ccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 36mg/kg (36mg/kg)   Journal of Medicinal Chemistry. Vol. 13, Pg. 1089, 1970.