CHEBI:100906 - (2R,3S,4R)-1-[2-(dimethylamino)-1-oxoethyl]-4-(hydroxymethyl)-3-[4-(2-methoxyphenyl)phenyl]-2-azetidinecarbonitrile

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ChEBI Name (2R,3S,4R)-1-[2-(dimethylamino)-1-oxoethyl]-4-(hydroxymethyl)-3-[4-(2-methoxyphenyl)phenyl]-2-azetidinecarbonitrile
ChEBI ID CHEBI:100906
Stars This entity has been manually annotated by a third party.
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Formula C22H25N3O3
Net Charge 0
Average Mass 379.453
Monoisotopic Mass 379.18959
InChI InChI=1S/C22H25N3O3/c1-24(2)13-21(27)25-18(12-23)22(19(25)14-26)16-10-8-15(9-11-16)17-6-4-5-7-20(17)28-3/h4-11,18-19,22,26H,13-14H2,1-3H3/t18-,19-,22-/m0/s1
InChIKey IQHJIJSRQPJLPZ-IPJJNNNSSA-N
SMILES CN(C)CC(=O)N1[C@H]([C@H]([C@@H]1C#N)C2=CC=C(C=C2)C3=CC=CC=C3OC)CO
ChEBI Ontology
Outgoing (2R,3S,4R)-1-[2-(dimethylamino)-1-oxoethyl]-4-(hydroxymethyl)-3-[4-(2-methoxyphenyl)phenyl]-2-azetidinecarbonitrile (CHEBI:100906) is a biphenyls (CHEBI:22888)
Manual Xref Database
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