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Substance Name: 2H-1,4-Benzoxazin-3(4H)-one, 4-(1-ethyl-3-pyrrolidinyl)-, fumarate (1:1)
RN: 21787-44-0
InChIKey: QIWVUQLHSHWMGG-WLHGVMLRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H18-N2-O2.C4-H4-O4

Molecular Weight

  • 362.38
 
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Names and Synonyms

Synonym

  • 4-(1-Ethyl-3-pyrrolidinyl)-2H-1,4-benzoxazin-3(4H)-one fumarate (1:1)

Systematic Name

  • 2H-1,4-Benzoxazin-3(4H)-one, 4-(1-ethyl-3-pyrrolidinyl)-, fumarate (1:1)

Registry Numbers

CAS Registry Number

  • 21787-44-0

System Generated Number

  • 0021787440

Molecular Formulas

Molecular Formula

  • C14-H18-N2-O2.C4-H4-O4

Molecular Formula Fragments

  • C14-H18-N2-O2
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C14H18N2O2.C4H4O4/c1-2-15-8-7-11(9-15)16-12-5-3-4-6-13(12)18-10-14(16)17;5-3(6)1-2-4(7)8/h3-6,11H,2,7-10H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

QIWVUQLHSHWMGG-WLHGVMLRSA-N

Smiles

N1(c2c(OCC1=O)cccc2)[C@@H]1C[N@@H+](CC)CC1.C(=C\C(=O)[O-])\C(O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal 160mg/kg (160mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 583, 1969.