[3-(2,6-Dichlorophenyl)-5-methyl-4-isoxazolyl]carbonyl N3-Acetylpenicilloic Acid

For research use only. Not for therapeutic Use.

  • CAT Number: R059291
  • CAS Number: 934986-84-2
  • Molecular Formula: C21H21Cl2N3O7S
  • Molecular Weight: 530.373
  • Purity: ≥95%
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Catalog Number R059291
CAS Number 934986-84-2
Synonyms

(αR,2R,4S)-3-Acetyl-4-carboxy-α-[[[3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolyl]carbonyl]amino]-5,5-dimethyl-2-thiazolidineacetic Acid;

Molecular Formula C21H21Cl2N3O7S
Purity ≥95%
Storage RT
IUPAC Name (2R,4S)-3-acetyl-2-[(R)-carboxy-[[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]methyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid
InChI InChI=1S/C21H21Cl2N3O7S/c1-8-12(14(25-33-8)13-10(22)6-5-7-11(13)23)17(28)24-15(19(29)30)18-26(9(2)27)16(20(31)32)21(3,4)34-18/h5-7,15-16,18H,1-4H3,(H,24,28)(H,29,30)(H,31,32)/t15-,16-,18+/m0/s1
InChIKey DLKZPLCKGFARLR-XYJFISCASA-N
SMILES CC1=C(C(=NO1)C2=C(C=CC=C2Cl)Cl)C(=O)NC(C3N(C(C(S3)(C)C)C(=O)O)C(=O)C)C(=O)O

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