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Substance Name: Benzoic acid, 2,2'-((2-((4-hydroxy-3-methoxyphenyl)methylene)-1,3-dioxo-1,3-propanediyl)diimino)bis-
RN: 100093-49-0
InChIKey: OBXDRXVVPNGBDZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H20-N2-O8

Molecular Weight

  • 476.439
 
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Names and Synonyms

Synonym

  • RTECS DL3654000

Systematic Name

  • Benzoic acid, 2,2'-((2-((4-hydroxy-3-methoxyphenyl)methylene)-1,3-dioxo-1,3-propanediyl)diimino)bis-

Registry Numbers

CAS Registry Number

  • 100093-49-0

System Generated Number

  • 0100093490

Structure Descriptors

InChI

1S/C25H20N2O8/c1-35-21-13-14(10-11-20(21)28)12-17(22(29)26-18-8-4-2-6-15(18)24(31)32)23(30)27-19-9-5-3-7-16(19)25(33)34/h2-13,28H,1H3,(H,26,29)(H,27,30)(H,31,32)(H,33,34)

InChIKey

OBXDRXVVPNGBDZ-UHFFFAOYSA-N

Smiles

COc1cc(ccc1O)C=C(C(=O)Nc2ccccc2C(=O)O)C(=O)Nc3ccccc3C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 275mg/kg (275mg/kg)   United States Patent Document. Vol. #4822791,
mouse LD50 oral > 10gm/kg (10000mg/kg)   United States Patent Document. Vol. #4822791,