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Substance Name: Pyrrolo(4,3,2-de)isoquinoline, 1,3,4,5-tetrahydro-3-(p-methoxyphenyl)-, maleate
RN: 53462-71-8
InChIKey: TWVDYUZROKDOAQ-WLHGVMLRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H16-N2-O.C4-H4-O4

Molecular Weight

  • 380.398
 
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Names and Synonyms

Synonym

  • 1,3,4,5-Tetrahydro-3-(p-methoxyphenyl)pyrrolo(4,3,2-de)isoquinoline maleate

Systematic Name

  • Pyrrolo(4,3,2-de)isoquinoline, 1,3,4,5-tetrahydro-3-(p-methoxyphenyl)-, maleate

Registry Numbers

CAS Registry Number

  • 53462-71-8

System Generated Number

  • 0053462718

Molecular Formulas

Molecular Formula

  • C17-H16-N2-O.C4-H4-O4

Molecular Formula Fragments

  • C17-H16-N2-O
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C17H16N2O.C4H4O4/c1-20-13-7-5-11(6-8-13)17-14-10-18-15-4-2-3-12(9-19-17)16(14)15;5-3(6)1-2-4(7)8/h2-8,10,17-19H,9H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

TWVDYUZROKDOAQ-WLHGVMLRSA-N

Smiles

COc1ccc(cc1)C2c3c[nH]c4c3c(ccc4)CN2.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 125mg/kg (125mg/kg)   Journal of Medicinal Chemistry. Vol. 17, Pg. 1140, 1974.