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Chemistry, part 1

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > cyanides > nitrile > 3-[4-[(1s,5r)-3-[(2-methoxyphenyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-7-yl]phenyl]benzonitrile

Preferred term

3-[4-[(1s,5r)-3-[(2-methoxyphenyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-7-yl]phenyl]benzonitrile  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C26H25N3O

inchi

  • InChI=1S/C26H25N3O/c1-30-25-8-3-2-6-22(25)15-29-16-23-26(24(17-29)28-23)20-11-9-19(10-12-20)21-7-4-5-18(13-21)14-27/h2-13,23-24,26,28H,15-17H2,1H3/t23-,24+,26?

inchikey

  • QOVFPCHJGWGUIZ-MAOIWGCQSA-N

mass

  • 395.497

monoisotopicmass

  • 395.19976

smiles

  • COC1=CC=CC=C1CN2C[C@@H]3C([C@H](C2)N3)C4=CC=C(C=C4)C5=CC=CC(=C5)C#N

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:125011

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