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Substance Name: 5-(3-Dimethylamino propyliden)-benzofuro(2,3-c)benzoxepin-1
RN: 76014-78-3
InChIKey: CGCXMZJMRNPIRE-SKOZGULJSA-N

Molecular Formula

  • C21-H21-N-O2.C4-H4-O4

Molecular Weight

  • 435.474
 
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Names and Synonyms

Name of Substance

  • 5-(3-Dimethylamino propyliden)-benzofuro(2,3-c)benzoxepin-1

Synonyms

  • 5-(3-Dimethylaminopropylidene)benzofuro(2,3-c)(1)benzoxepin fumarate
  • EINECS 278-360-5

Systematic Names

  • (3-Benzofuro(2,3-c)(1)benzoxepin-12(6H)-ylidenepropyl)dimethylammonium hydrogen fumarate
  • 1-Propanamine, 3-benzofuro(2,3-c)(1)benzoxepin-12(6H)-ylidene-N,N-dimethyl-, (E)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 76014-78-3

System Generated Number

  • 0076014783

Molecular Formulas

Molecular Formula

  • C21-H21-N-O2.C4-H4-O4

Molecular Formula Fragments

  • C21-H21-N-O2
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C21H21NO2.C4H4O4/c1-22(2)13-7-10-16-15-8-3-5-11-18(15)23-14-20-21(16)17-9-4-6-12-19(17)24-20;5-3(6)1-2-4(7)8/h3-6,8-12H,7,13-14H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b16-10-;2-1+

InChIKey

CGCXMZJMRNPIRE-SKOZGULJSA-N

Smiles

O1Cc2oc3c(cccc3)c2\C(=C/CCN(C)C)c2c1cccc2.C(=C\C(O)=O)\C(O)=O