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Substance Name: Propanoic acid, 2-((5,6-dihydro-7-(1H-imidazol-1-yl)-2-naphthalenyl)oxy)-2-methyl-, ethyl ester, (Z)-2-butenedioate (1:1)
RN: 108957-94-4
InChIKey: NAEMVELZXVEWMB-WLHGVMLRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H22-N2-O3

Molecular Weight

  • 442.4654
 
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Names and Synonyms

  • Propanoic acid, 2-((5,6-dihydro-7-(1H-imidazol-1-yl)-2-naphthalenyl)oxy)-2-methyl-, ethyl ester, (Z)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 108957-94-4

Related Registry Number

  • 89781-84-0 (Parent)

System Generated Number

  • 0108957944

Structure Descriptors

InChI

1S/C19H22N2O3.C4H4O4/c1-4-23-18(22)19(2,3)24-17-8-6-14-5-7-16(11-15(14)12-17)21-10-9-20-13-21;5-3(6)1-2-4(7)8/h6,8-13H,4-5,7H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

NAEMVELZXVEWMB-WLHGVMLRSA-N

Smiles

CCOC(=O)C(C)(C)Oc1ccc2c(c1)C=C(CC2)n3ccnc3.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral > 3200mg/kg (3200mg/kg)   Farmaco, Edizione Scientifica. Vol. 42, Pg. 205, 1987.