(+)-202-791

CAS Registry Number®

97217-83-9
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CAS Name

(+)-202-791

Molecular Formula

C17H18N4O5

Molecular Mass

358.35

Cite this Page

(+)-202-791.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=97217-83-9 (retrieved 2024-08-14) (CAS RN: 97217-83-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H18N4O5/c1-8(2)25-17(22)13-9(3)18-10(4)16(21(23)24)14(13)11-6-5-7-12-15(11)20-26-19-12/h5-8,14,18H,1-4H3/t14-/m0/s1

InChIKey

InChIKey=LYFZEFDZKPJBJK-AWEZNQCLSA-N

SMILES

C(OC(C)C)(=O)C=1[C@@H](C(N(=O)=O)=C(C)NC1C)C=2C=3C(C=CC2)=NON3

Canonical SMILES

O=C(OC(C)C)C1=C(NC(=C(N(=O)=O)C1C2=CC=CC3=NON=C32)C)C

Other Names for this Substance

  • 3-Pyridinecarboxylic acid, 4-(2,1,3-benzoxadiazol-4-yl)-1,4-dihydro-2,6-dimethyl-5-nitro-, 1-methylethyl ester, (4S)-
  • 3-Pyridinecarboxylic acid, 4-(4-benzofurazanyl)-1,4-dihydro-2,6-dimethyl-5-nitro-, 1-methylethyl ester, (S)-
  • 2,1,3-Benzoxadiazole, 3-pyridinecarboxylic acid deriv.
  • (+)-PN 202-791
  • (S)-(+)-Sandoz 202-791

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Deleted or Replaced CAS Registry Numbers

101342-80-7, 111002-27-8