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Substance Name: NSC 2964
RN: 5335-59-1
InChIKey: KRUHQBUNFDJMRN-GIVPXCGWSA-N

Molecular Formula

  • C21-H29-Br-O2

Molecular Weight

  • 393.3621
 
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Names and Synonyms

Results Name

  • NSC 2964

Synonym

  • NSC 2964

Systematic Name

  • 1-Phenanthrenecarboxylic acid, 6-bromo-1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-, methyl ester, (1S,4aR,10aR)-

Registry Numbers

CAS Registry Number

  • 5335-59-1

System Generated Number

  • 0005335591

Structure Descriptors

InChI

1S/C21H29BrO2/c1-13(2)15-11-14-7-8-18-20(3,16(14)12-17(15)22)9-6-10-21(18,4)19(23)24-5/h11-13,18H,6-10H2,1-5H3/t18-,20+,21+/m1/s1

InChIKey

KRUHQBUNFDJMRN-GIVPXCGWSA-N

Smiles

CC(C)c1cc2c(cc1Br)[C@@]3(CCC[C@]([C@@H]3CC2)(C)C(=O)OC)C