N-(1-adamantylmethyl)-3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazole-5-carboxamide

Systemtic Name: N-(1-adamantylmethyl)-3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazole-5-carboxamide Openeye Name: N-(1-adamantylmethyl)-3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazole-5-carboxamide CAS Name: N-(1-adamantylmethyl)-3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazole-5-carboxamide IUPAC Name: N-(1-adamantylmethyl)-3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazole-5-carboxamide Traditional Name: N-(1-adamantylmethyl)-3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazole-5-carboxamide Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CNC(=O)C4=NC(=NO4)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CNC(=O)C4=NC(=NO4)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C21H23N3O4/c25-19(22-10-21-7-12-3-13(8-21)5-14(4-12)9-21)20-23-18(24-28-20)15-1-2-16-17(6-15)27-11-26-16/h1-2,6,12-14H,3-5,7-11H2,(H,22,25)