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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 > (1s,5r)-7-[4-(3-cyanophenyl)phenyl]-n-(2-methoxyphenyl)-3,6-diazabicyclo[3.1.1]heptane-3-carboxamide

Preferred term

(1s,5r)-7-[4-(3-cyanophenyl)phenyl]-n-(2-methoxyphenyl)-3,6-diazabicyclo[3.1.1]heptane-3-carboxamide  

Type

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

Broader concept

charge

  • 0

formula

  • C26H24N4O2

inchi

  • InChI=1S/C26H24N4O2/c1-32-24-8-3-2-7-21(24)29-26(31)30-15-22-25(23(16-30)28-22)19-11-9-18(10-12-19)20-6-4-5-17(13-20)14-27/h2-13,22-23,25,28H,15-16H2,1H3,(H,29,31)/t22-,23+,25?

inchikey

  • KZGDUPVRHRQTLE-HCGNOCCLSA-N

mass

  • 424.495

monoisotopicmass

  • 424.18993

smiles

  • COC1=CC=CC=C1NC(=O)N2C[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:125082

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