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Substance Name: 5H-Benzocyclohepten-6-amine, 6,7,8,9-tetrahydro-N-methyl-2,3,4-trimethoxy-, oxalate (2:1)
RN: 50823-59-1
InChIKey: RTWCYHHNRNFUPF-UHFFFAOYSA-O
Classification Code
- Drug / Therapeutic Agent
Molecular Formula
- C15-H23-N-O3.1/2C2-H2-O4
Molecular Weight
- 621.743
Names and Synonyms
Synonyms
- 6-(N-Methyl)amino-2,3,4-trimethoxybenzocycloheptane oxalate
- N-Methyl-2,3,4-trimethoxy-6,7,8,9-tetrahydro-5H-benzocyclohepten-6-amine oxalate (2:1)
Systematic Name
- 5H-Benzocyclohepten-6-amine, 6,7,8,9-tetrahydro-N-methyl-2,3,4-trimethoxy-, oxalate (2:1)
Registry Numbers
CAS Registry Number
- 50823-59-1
System Generated Number
- 0050823591
Molecular Formulas
Molecular Formula
- C15-H23-N-O3.1/2C2-H2-O4
Molecular Formula Fragments
- C15-H23-N-O3
- C2-H2-O4
- COMPONENT
Structure Descriptors
InChI
1S/2C15H23NO3.C2H2O4/c2*1-16-11-7-5-6-10-8-13(17-2)15(19-4)14(18-3)12(10)9-11;3-1(4)2(5)6/h2*5-7,13-16H,8-9H2,1-4H3;(H,3,4)(H,5,6)/p+1InChIKey
RTWCYHHNRNFUPF-UHFFFAOYSA-OSmiles
C=12[C@@H]([C@@H]([C@@H](OC)Toxicity
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intravenous | 63100ug/kg (63.1mg/kg) | Journal of Medicinal Chemistry. Vol. 16, Pg. 1394, 1973. |