8-[(3-Nitrobenzoyl)amino]-1,3,5-naphthalenetrisulfonic acid

CAS Registry Number®

339526-05-5
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CAS Name

8-[(3-Nitrobenzoyl)amino]-1,3,5-naphthalenetrisulfonic acid

Molecular Formula

C17H12N2O12S3

Molecular Mass

532.48

Cite this Page

8-[(3-Nitrobenzoyl)amino]-1,3,5-naphthalenetrisulfonic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=339526-05-5 (retrieved 2024-09-10) (CAS RN: 339526-05-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H12N2O12S3/c20-17(9-2-1-3-10(6-9)19(21)22)18-13-4-5-14(33(26,27)28)12-7-11(32(23,24)25)8-15(16(12)13)34(29,30)31/h1-8H,(H,18,20)(H,23,24,25)(H,26,27,28)(H,29,30,31)

InChIKey

InChIKey=REIQTUMOJLZAOH-UHFFFAOYSA-N

SMILES

N(C(=O)C1=CC(N(=O)=O)=CC=C1)C=2C3=C(C(S(=O)(=O)O)=CC2)C=C(S(=O)(=O)O)C=C3S(=O)(=O)O

Canonical SMILES

O=C(NC1=CC=C(C2=CC(=CC(=C12)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)C3=CC=CC(=C3)N(=O)=O

Other Names for this Substance

  • 1,3,5-Naphthalenetrisulfonic acid, 8-[(3-nitrobenzoyl)amino]-
  • 8-[(3-Nitrobenzoyl)amino]-1,3,5-naphthalenetrisulfonic acid

Deleted or Replaced CAS Registry Numbers

858186-33-1