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Substance Name: 4H-1-Benzopyran-2-carboxylic acid, 4-oxo-, 2-(aminocarbonyl)cyclohexyl ester
RN: 32773-99-2
InChIKey: UKQDPWYXWLDSKH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H17-N-O5

Molecular Weight

  • 315.323
 
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Names and Synonyms

Synonym

  • 4-Oxo-4H-1-benzopyran-2-carboxylic acid 2-(aminocarbonyl)cyclohexyl ester

Systematic Name

  • 4H-1-Benzopyran-2-carboxylic acid, 4-oxo-, 2-(aminocarbonyl)cyclohexyl ester

Registry Numbers

CAS Registry Number

  • 32773-99-2

System Generated Number

  • 0032773992

Structure Descriptors

InChI

1S/C17H17NO5/c18-16(20)11-6-2-4-8-14(11)23-17(21)15-9-12(19)10-5-1-3-7-13(10)22-15/h1,3,5,7,9,11,14H,2,4,6,8H2,(H2,18,20)

InChIKey

UKQDPWYXWLDSKH-UHFFFAOYSA-N

Smiles

c1(cc(c2c(o1)cccc2)=O)C(=O)O[C@@H]1[C@@H](CCCC1)C(=O)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1200mg/kg (1200mg/kg)   United States Patent Document. Vol. #3816470,