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Substance Name: 3-(((4-(Bis(2-chloroethyl)amino)phenyl)acetyl)oxy)-17a-aza-D-homoandrost-5-en-17-one
RN: 53039-94-4
InChIKey: REYWQKDXELGBMI-DIUBKPNJSA-N

Molecular Formula

  • C31-H42-Cl2-N2-O3

Molecular Weight

  • 561.59
 
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Names and Synonyms

Name of Substance

  • 3-(((4-(Bis(2-chloroethyl)amino)phenyl)acetyl)oxy)-17a-aza-D-homoandrost-5-en-17-one

Synonyms

  • 3-beta-Hydroxy-13alpha-amino-13,17-seco-5-androsten-17-oic-13,17-lactam p-N,N-bis(2-chloroethyl)aminophenylacetate
  • BCCHO
  • Homo-aza-androstene ester of p-bis(2-chloroethyl)aminophenylacetic acid

Systematic Name

  • 17a-Aza-D-homoandrost-5-en-17-one, 3-(((4-(bis(2-chloroethyl)amino)phenyl)acetyl)oxy)-, (3beta)-

Registry Numbers

CAS Registry Number

  • 53039-94-4

System Generated Number

  • 0053039944

Structure Descriptors

InChI

1S/C31H42Cl2N2O3/c1-30-13-11-24(38-29(37)19-21-3-6-23(7-4-21)35(17-15-32)18-16-33)20-22(30)5-8-25-26(30)12-14-31(2)27(25)9-10-28(36)34-31/h3-7,24-27H,8-20H2,1-2H3,(H,34,36)/t24-,25+,26-,27-,30-,31-/m0/s1

InChIKey

REYWQKDXELGBMI-DIUBKPNJSA-N

Smiles

c1(ccc(N(CCCl)CCCl)cc1)CC(O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4([C@H](CCC(N4)=O)[C@@H]3CC=C2C1)C)=O