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Substance Name: Benzonitrile, 4-(5-(trans-4-pentylcyclohexyl)-2-pyrimidinyl)-
RN: 72785-09-2
InChIKey: XIXOFKHADLKBQN-UHFFFAOYSA-N

Molecular Formula

  • C22-H27-N3

Molecular Weight

  • 333.4763
 
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Names and Synonyms

Synonym

  • trans-4-(5-(4-Pentylcyclohexyl)-2-pyrimidinyl)benzonitrile

Systematic Name

  • Benzonitrile, 4-(5-(trans-4-pentylcyclohexyl)-2-pyrimidinyl)-

Registry Numbers

CAS Registry Number

  • 72785-09-2

System Generated Number

  • 0072785092

Structure Descriptors

InChI

1S/C22H27N3/c1-2-3-4-5-17-6-10-19(11-7-17)21-15-24-22(25-16-21)20-12-8-18(14-23)9-13-20/h8-9,12-13,15-17,19H,2-7,10-11H2,1H3

InChIKey

XIXOFKHADLKBQN-UHFFFAOYSA-N

Smiles

CCCCCC1CCC(CC1)c2cnc(nc2)c3ccc(cc3)C#N