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Substance Name: 4,4'-Biphenyldicarboxylic acid, compd. with 3-(2-aminoethyl)indol-5-ol, acetate (1:2:2)
ID: DV30000000
InChIKey: FPLAEQNCSRJYPJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C34-H30-N4-O4.2C2-H4-O2

Molecular Weight

  • 678.7382
 
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Names and Synonyms

Synonym

  • 4,4'-Biphenyldicarboxylic acid, bis(3-(2-aminoethyl)-5-indolyl) ester, diacetate

Systematic Name

  • 4,4'-Biphenyldicarboxylic acid, compd. with 3-(2-aminoethyl)indol-5-ol, acetate (1:2:2)

Registry Numbers

ID Number

  • NIOSH/DV3000000

System Generated Number

  • DV30000000

Molecular Formulas

Molecular Formula

  • C34-H30-N4-O4.2C2-H4-O2

Molecular Formula Fragments

  • C2-H4-O2
  • C34-H30-N4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C18H14O6.2C10H12N2O/c1-11(19)23-17(21)15-7-3-13(4-8-15)14-5-9-16(10-6-14)18(22)24-12(2)20;2*11-4-3-7-6-12-10-2-1-8(13)5-9(7)10/h3-10H,1-2H3;2*1-2,5-6,12-13H,3-4,11H2

InChIKey

FPLAEQNCSRJYPJ-UHFFFAOYSA-N

Smiles

CC(=O)OC(=O)c1ccc(cc1)c2ccc(cc2)C(=O)OC(=O)C.NCCc3c[nH]c4ccc(O)cc34.NCCc5c[nH]c6ccc(O)cc56