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Substance Name: 2-(((2-((Hydroxymethyl)(2-((1-oxoisononyl)amino)ethyl)amino)ethyl)amino)carbonyl)benzoic acid
RN: 100063-56-7
InChIKey: KXWBMYVIQBCGJO-UHFFFAOYSA-N

Molecular Formula

  • C22-H35-N3-O5

Molecular Weight

  • 421.534
 
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Names and Synonyms

Synonym

  • EINECS 309-120-0

Systematic Name

  • 2-(((2-((Hydroxymethyl)(2-((1-oxoisononyl)amino)ethyl)amino)ethyl)amino)carbonyl)benzoic acid

Registry Numbers

CAS Registry Number

  • 100063-56-7

System Generated Number

  • 0100063567

Structure Descriptors

InChI

1S/C22H35N3O5/c1-17(2)8-4-3-5-11-20(27)23-12-14-25(16-26)15-13-24-21(28)18-9-6-7-10-19(18)22(29)30/h6-7,9-10,17,26H,3-5,8,11-16H2,1-2H3,(H,23,27)(H,24,28)(H,29,30)

InChIKey

KXWBMYVIQBCGJO-UHFFFAOYSA-N

Smiles

c1(c(C(=O)O)cccc1)C(=O)NCC[N@@](CO)CCNC(=O)CCCCCC(C)C