1,3,4,6,7,9,9b-Heptaazaphenalene-2,5,8(1H,3H,6H)-trione

CAS Registry Number®

1502-46-1

CAS Name

1,3,4,6,7,9,9b-Heptaazaphenalene-2,5,8(1H,3H,6H)-trione

Molecular Formula

C6H3N7O3

Molecular Mass

221.13

Cite this Page

1,3,4,6,7,9,9b-Heptaazaphenalene-2,5,8(1H,3H,6H)-trione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1502-46-1 (retrieved 2024-11-22) (CAS RN: 1502-46-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C6H3N7O3/c14-4-7-1-8-5(15)10-3-12-6(16)11-2(9-4)13(1)3/h(H3,7,8,9,10,11,12,14,15,16)

InChIKey

InChIKey=PBKYCCOBOHDCIT-UHFFFAOYSA-N

SMILES

O=C1NC=2N3C(NC(=O)NC3=N1)=NC(=O)N2

Canonical SMILES

O=C1N=C2NC(=O)N=C3NC(=O)NC(=N1)N23

Other Names for this Substance

  • 1,3,4,6,7,9,9b-Heptaazaphenalene-2,5,8(1H,3H,6H)-trione
  • Cyameluric acid
  • 1,3,4,6,7,9,9b-Heptaazaphenalene-2,5,8-triol
  • NSC 156433
  • 2,5,8-Trihydroxy-1,3,4,6,7,9,9b-heptaazaphenalene