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Substance Name: 3-Hydroxy-17-aza-D-homoandrostan-4-N,N-bis(2-chloroethyl)aminophenylacetate
RN: 146678-51-5
InChIKey: CPICDLRHHBTQBZ-ABKLYSGHSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C31-H46-Cl2-N2-O2

Molecular Weight

  • 549.6224
 
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Names and Synonyms

Name of Substance

  • 3-Hydroxy-17-aza-D-homoandrostan-4-N,N-bis(2-chloroethyl)aminophenylacetate

Synonym

  • 3-Hydroxy-17-aza-D-homoandrostan-4-N,N-bis(2-chloroethyl)aminophenylacetate

Systematic Name

  • 17a-Aza-D-homoandrostan-3-ol, 4-(bis(2-chloroethyl)amino)benzeneacetate (ester), (3-beta,5-alpha)-

Registry Numbers

CAS Registry Number

  • 146678-51-5

System Generated Number

  • 0146678515

Structure Descriptors

InChI

1S/C31H46Cl2N2O2/c1-30-13-11-25(37-29(36)20-22-5-8-24(9-6-22)35(18-15-32)19-16-33)21-23(30)7-10-26-27(30)12-14-31(2)28(26)4-3-17-34-31/h5-6,8-9,23,25-28,34H,3-4,7,10-21H2,1-2H3/t23-,25-,26+,27-,28-,30-,31-/m0/s1

InChIKey

CPICDLRHHBTQBZ-ABKLYSGHSA-N

Smiles

C[C@]12CC[C@@H](C[C@@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CCCN4)C)OC(=O)Cc5ccc(cc5)N(CCCl)CCCl