N'-oxidanyl-N-[3-(3-phenyl-1,2,3-triazol-4-yl)phenyl]octanediamide

Systemtic Name: N'-oxidanyl-N-[3-(3-phenyl-1,2,3-triazol-4-yl)phenyl]octanediamide Openeye Name: 8-(hydroxyamino)-8-oxo-N-[3-(3-phenyltriazol-4-yl)phenyl]octanamide CAS Name: N'-hydroxy-N-[3-(3-phenyl-4-triazolyl)phenyl]octanediamide IUPAC Name: N'-hydroxy-N-[3-(3-phenyltriazol-4-yl)phenyl]octanediamide Traditional Name: 8-(hydroxyamino)-8-keto-N-[3-(3-phenyltriazol-4-yl)phenyl]caprylamide Formula: C22H25N5O3 MolecularWeight: 407.4656

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=CN=N2)C3=CC(=CC=C3)NC(=O)CCCCCCC(=O)NO

Isomeric SMILES

C1=CC=C(C=C1)N2C(=CN=N2)C3=CC(=CC=C3)NC(=O)CCCCCCC(=O)NO

InChI

InChI=1S/C22H25N5O3/c28-21(13-6-1-2-7-14-22(29)25-30)24-18-10-8-9-17(15-18)20-16-23-26-27(20)19-11-4-3-5-12-19/h3-5,8-12,15-16,30H,1-2,6-7,13-14H2,(H,24,28)(H,25,29)