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Substance Name: Benzenemethanaminium, N-(3-((9,10-dihydro-4-((1-methylethyl)amino)-9,10-dioxo-1-anthracenyl)amino)propyl)-N,N-dimethyl-, chloride (1:1)
RN: 35402-38-1
InChIKey: BIZUKZMQPYVJJF-UHFFFAOYSA-N

Molecular Formula

  • C29-H34-N3-O2.Cl

Molecular Weight

  • 492.06
 
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Names and Synonyms

Synonym

  • EINECS 252-547-1

Systematic Names

  • Benzenemethanaminium, N-(3-((9,10-dihydro-4-((1-methylethyl)amino)-9,10-dioxo-1-anthracenyl)amino)propyl)-N,N-dimethyl-, chloride
  • Benzenemethanaminium, N-(3-((9,10-dihydro-4-((1-methylethyl)amino)-9,10-dioxo-1-anthracenyl)amino)propyl)-N,N-dimethyl-, chloride (1:1)
  • Benzyl(3-((9,10-dihydro-4-(isopropylamino)-9,10-dioxo-1-anthryl)amino)propyl)dimethylammonium chloride

Registry Numbers

CAS Registry Number

  • 35402-38-1

System Generated Number

  • 0035402381

Molecular Formulas

Molecular Formula

  • C29-H34-N3-O2.Cl

Molecular Formula Fragments

  • C29-H34-N3-O2
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C29H33N3O2.ClH/c1-20(2)31-25-16-15-24(26-27(25)29(34)23-14-9-8-13-22(23)28(26)33)30-17-10-18-32(3,4)19-21-11-6-5-7-12-21;/h5-9,11-16,20H,10,17-19H2,1-4H3,(H-,30,31,33,34);1H

InChIKey

BIZUKZMQPYVJJF-UHFFFAOYSA-N

Smiles

c12c(C(=O)c3c(C1=O)cccc3)c(NCCC[N+](Cc1ccccc1)(C)C)ccc2NC(C)C.[ClH-]