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CHEBI:97487 - (2R,3S,4S)-2-cyano-N-(3-fluorophenyl)-4-(hydroxymethyl)-3-phenylazetidine-1-carboxamide

Default Structure
ChEBI IDCHEBI:97487
ChEBI Name(2R,3S,4S)-2-cyano-N-(3-fluorophenyl)-4-(hydroxymethyl)-3-phenylazetidine-1-carboxamide
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DownloadsMolfile
FormulaC18H16FN3O2
Net Charge0
Average Mass325.343
Monoisotopic Mass325.12265
SMILESN#C[C@H]1[C@H](c2ccccc2)[C@@H](CO)N1C(=O)Nc1cccc(F)c1
InChIInChI=1S/C18H16FN3O2/c19-13-7-4-8-14(9-13)21-18(24)22-15(10-20)17(16(22)11-23)12-5-2-1-3-6-12/h1-9,15-17,23H,11H2,(H,21,24)/t15-,16+,17-/m0/s1
InChIKeyNDKYDEPQZPJKDZ-BBWFWOEESA-N
ChEBI Ontology
Outgoing Relation(s)
(2R,3S,4S)-2-cyano-N-(3-fluorophenyl)-4-(hydroxymethyl)-3-phenylazetidine-1-carboxamide (CHEBI:97487) is a azetidines (CHEBI:38777)
(2R,3S,4S)-2-cyano-N-(3-fluorophenyl)-4-(hydroxymethyl)-3-phenylazetidine-1-carboxamide (CHEBI:97487) is a benzenes (CHEBI:22712)
(2R,3S,4S)-2-cyano-N-(3-fluorophenyl)-4-(hydroxymethyl)-3-phenylazetidine-1-carboxamide (CHEBI:97487) is a ring assembly (CHEBI:36820)
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