6-Amino-1,4-dihydro-3-methyl-4-(3-nitrophenyl)pyrano[2,3-c]pyrazole-5-carbonitrile

CAS Registry Number®

81000-13-7

CAS Name

6-Amino-1,4-dihydro-3-methyl-4-(3-nitrophenyl)pyrano[2,3-c]pyrazole-5-carbonitrile

Molecular Formula

C14H11N5O3

Molecular Mass

297.27

Cite this Page

6-Amino-1,4-dihydro-3-methyl-4-(3-nitrophenyl)pyrano[2,3-c]pyrazole-5-carbonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=81000-13-7 (retrieved 2024-11-29) (CAS RN: 81000-13-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    232 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C14H11N5O3/c1-7-11-12(8-3-2-4-9(5-8)19(20)21)10(6-15)13(16)22-14(11)18-17-7/h2-5,12H,16H2,1H3,(H,17,18)

InChIKey

InChIKey=JBJAWVQREDWYEK-UHFFFAOYSA-N

SMILES

C(#N)C=1C(C2=C(OC1N)NN=C2C)C3=CC(N(=O)=O)=CC=C3

Canonical SMILES

N#CC1=C(OC=2NN=C(C2C1C=3C=CC=C(C3)N(=O)=O)C)N

Other Names for this Substance

  • Pyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-1,4-dihydro-3-methyl-4-(3-nitrophenyl)-
  • 6-Amino-1,4-dihydro-3-methyl-4-(3-nitrophenyl)pyrano[2,3-c]pyrazole-5-carbonitrile
  • 6-Amino-3-methyl-4-(3-nitrophenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

Deleted or Replaced CAS Registry Numbers

1421330-32-6, 2885978-50-5

CAS INSIGHTSTM
Hourglass and a clock