1-adamantyl(1,2,4-triazol-1-yl)methanone

Systemtic Name: 1-adamantyl(1,2,4-triazol-1-yl)methanone Openeye Name: 1-adamantyl(1,2,4-triazol-1-yl)methanone CAS Name: 1-adamantyl(1,2,4-triazol-1-yl)methanone IUPAC Name: 1-adamantyl(1,2,4-triazol-1-yl)methanone Traditional Name: 1-adamantyl(1,2,4-triazol-1-yl)methanone Formula: C13H17N3O MolecularWeight: 231.29358

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)N4C=NC=N4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)N4C=NC=N4

InChI

InChI=1S/C13H17N3O/c17-12(16-8-14-7-15-16)13-4-9-1-10(5-13)3-11(2-9)6-13/h7-11H,1-6H2