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Substance Name: 1-Naphthaleneacetaldehyde, alpha-butyl-alpha-(2-piperidinoethyl)-
RN: 30301-10-1
InChIKey: WAJSAVZFRTWYIR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H31-N-O

Molecular Weight

  • 337.504
 
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Names and Synonyms

Synonyms

  • 5-20-02-00372 (Beilstein Handbook Reference)
  • alpha-Butyl-alpha-(2-piperidinoethyl)-1-naphthaleneacetaldehyde
  • BRN 1657013
  • NSC 171395

Systematic Names

  • 1-Naphthaleneacetaldehyde, alpha-butyl-alpha-(2-piperidinoethyl)-
  • 1-Piperidinebutyraldehyde, alpha-butyl-alpha-1-naphthyl- (8CI)

Registry Numbers

CAS Registry Number

  • 30301-10-1

System Generated Number

  • 0030301101

Structure Descriptors

InChI

1S/C23H31NO/c1-2-3-14-23(19-25,15-18-24-16-7-4-8-17-24)22-13-9-11-20-10-5-6-12-21(20)22/h5-6,9-13,19H,2-4,7-8,14-18H2,1H3

InChIKey

WAJSAVZFRTWYIR-UHFFFAOYSA-N

Smiles

c1(c2c(cccc2)ccc1)[C@@](CCN1CCCCC1)(C=O)CCCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 140mg/kg (140mg/kg)   Journal of Medicinal Chemistry. Vol. 13, Pg. 1089, 1970.