2-[(Methoxycarbonyl)amino]-1H-benzimidazole-6-sulfonic acid

CAS Registry Number®

79213-79-9
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CAS Name

2-[(Methoxycarbonyl)amino]-1H-benzimidazole-6-sulfonic acid

Molecular Formula

C9H9N3O5S

Molecular Mass

271.25

Cite this Page

2-[(Methoxycarbonyl)amino]-1H-benzimidazole-6-sulfonic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=79213-79-9 (retrieved 2024-09-07) (CAS RN: 79213-79-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H9N3O5S/c1-17-9(13)12-8-10-6-3-2-5(18(14,15)16)4-7(6)11-8/h2-4H,1H3,(H,14,15,16)(H2,10,11,12,13)

InChIKey

InChIKey=NMHSXXPZLXHOJO-UHFFFAOYSA-N

SMILES

N(C(OC)=O)C=1NC=2C(N1)=CC=C(S(=O)(=O)O)C2

Canonical SMILES

O=C(OC)NC1=NC=2C=CC(=CC2N1)S(=O)(=O)O

Other Names for this Substance

  • 1H-Benzimidazole-6-sulfonic acid, 2-[(methoxycarbonyl)amino]-
  • 1H-Benzimidazole-5-sulfonic acid, 2-[(methoxycarbonyl)amino]-
  • 2-[(Methoxycarbonyl)amino]-1H-benzimidazole-6-sulfonic acid