5-[4-(1-adamantyl)-3-phenyl-5H-1,2,4-oxadiazol-5-yl]-2-chloranyl-N-oxidanyl-benzeneamine oxide

Systemtic Name: 5-[4-(1-adamantyl)-3-phenyl-5H-1,2,4-oxadiazol-5-yl]-2-chloranyl-N-oxidanyl-benzeneamine oxide Openeye Name: 5-[4-(1-adamantyl)-3-phenyl-5H-1,2,4-oxadiazol-5-yl]-2-chloro-N-hydroxy-benzeneamine oxide CAS Name: 5-[4-(1-adamantyl)-3-phenyl-5H-1,2,4-oxadiazol-5-yl]-2-chloro-N-hydroxybenzeneamine oxide IUPAC Name: 5-[4-(1-adamantyl)-3-phenyl-5H-1,2,4-oxadiazol-5-yl]-2-chloro-N-hydroxybenzeneamine oxide Traditional Name: 5-[4-(1-adamantyl)-3-phenyl-5H-1,2,4-oxadiazol-5-yl]-2-chloro-N-hydroxy-benzeneamine oxide Formula: C24H26ClN3O3 MolecularWeight: 439.93454

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)N4C(ON=C4C5=CC=CC=C5)C6=CC(=C(C=C6)Cl)[NH+](O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)N4C(ON=C4C5=CC=CC=C5)C6=CC(=C(C=C6)Cl)[NH+](O)[O-]

InChI

InChI=1S/C24H26ClN3O3/c25-20-7-6-19(11-21(20)28(29)30)23-27(22(26-31-23)18-4-2-1-3-5-18)24-12-15-8-16(13-24)10-17(9-15)14-24/h1-7,11,15-17,23,28-29H,8-10,12-14H2