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Substance Name: Pyrrolo(3,2-f)(1,3)benzoxazine-9-carboxylic acid, 1,2,3,7-tetrahydro-2-(3-(diethylamino)propyl)-8-methyl-, ethyl ester
RN: 54436-04-3
InChIKey: NHTUZFHDKXUPOR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H31-N3-O3

Molecular Weight

  • 373.4939
 
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Names and Synonyms

  • Pyrrolo(3,2-f)(1,3)benzoxazine-9-carboxylic acid, 1,2,3,7-tetrahydro-2-(3-(diethylamino)propyl)-8-methyl-, ethyl ester

Registry Numbers

CAS Registry Number

  • 54436-04-3

System Generated Number

  • 0054436043

Structure Descriptors

InChI

1S/C21H31N3O3/c1-5-23(6-2)11-8-12-24-13-16-18(27-14-24)10-9-17-20(16)19(15(4)22-17)21(25)26-7-3/h9-10,22H,5-8,11-14H2,1-4H3

InChIKey

NHTUZFHDKXUPOR-UHFFFAOYSA-N

Smiles

CCN(CC)CCCN1Cc2c(ccc3c2c(c([nH]3)C)C(=O)OCC)OC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 oral 900mg/kg (900mg/kg)   United States Patent Document. Vol. #3959270,