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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > (2r,3r)-nemonapride(1+)

Preferred term

(2r,3r)-nemonapride(1+)  

Type

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

Broader concept

charge

  • +1

formula

  • C21H27ClN3O2

inchi

  • InChI=1S/C21H26ClN3O2/c1-14-18(9-10-25(14)13-15-7-5-4-6-8-15)24-21(26)16-11-17(22)19(23-2)12-20(16)27-3/h4-8,11-12,14,18,23H,9-10,13H2,1-3H3,(H,24,26)/p+1/t14-,18-/m1/s1

inchikey

  • KRVOJOCLBAAKSJ-RDTXWAMCSA-O

is_conjugate_acid_of

mass

  • 388.920

monoisotopicmass

  • 388.17863

smiles

  • C(=O)(C1=C(C=C(C(=C1)Cl)NC)OC)N[C@H]2[C@H]([NH+](CC2)CC3=CC=CC=C3)C

subset

  • 2_STAR

synonym RELATED

  • (2R,3R)-nemonapride

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:188145

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