6,7,8,9-Tetrahydro-3-[1-(4-nitro-1H-pyrazol-1-yl)ethyl]-5H-1,2,4-triazolo[4,3-a]azepine

CAS Registry Number®

1245772-21-7
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CAS Name

6,7,8,9-Tetrahydro-3-[1-(4-nitro-1H-pyrazol-1-yl)ethyl]-5H-1,2,4-triazolo[4,3-a]azepine

Molecular Formula

C12H16N6O2

Molecular Mass

276.29

Cite this Page

6,7,8,9-Tetrahydro-3-[1-(4-nitro-1H-pyrazol-1-yl)ethyl]-5H-1,2,4-triazolo[4,3-a]azepine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1245772-21-7 (retrieved 2024-05-20) (CAS RN: 1245772-21-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H16N6O2/c1-9(17-8-10(7-13-17)18(19)20)12-15-14-11-5-3-2-4-6-16(11)12/h7-9H,2-6H2,1H3

InChIKey

InChIKey=IQSQOGBESYJNQB-UHFFFAOYSA-N

SMILES

C(C)(C=1N2C(=NN1)CCCCC2)N3C=C(N(=O)=O)C=N3

Canonical SMILES

O=N(=O)C=1C=NN(C1)C(C2=NN=C3N2CCCCC3)C

Other Names for this Substance

  • 5H-1,2,4-Triazolo[4,3-a]azepine, 6,7,8,9-tetrahydro-3-[1-(4-nitro-1H-pyrazol-1-yl)ethyl]-
  • 6,7,8,9-Tetrahydro-3-[1-(4-nitro-1H-pyrazol-1-yl)ethyl]-5H-1,2,4-triazolo[4,3-a]azepine

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