1-[(5S,7R)-3-chloranyl-1-adamantyl]-1,2,4-triazole

Systemtic Name: 1-[(5S,7R)-3-chloranyl-1-adamantyl]-1,2,4-triazole Openeye Name: 1-[(5S,7R)-3-chloro-1-adamantyl]-1,2,4-triazole CAS Name: 1-[(5S,7R)-3-chloro-1-adamantyl]-1,2,4-triazole IUPAC Name: 1-[(5S,7R)-3-chloro-1-adamantyl]-1,2,4-triazole Traditional Name: 1-[(5S,7R)-3-chloro-1-adamantyl]-1,2,4-triazole Formula: C12H16ClN3 MolecularWeight: 237.72854

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)Cl)N4C=NC=N4

Isomeric SMILES

C1[C@@H]2CC3(C[C@H]1CC(C2)(C3)Cl)N4C=NC=N4

InChI

InChI=1S/C12H16ClN3/c13-11-2-9-1-10(3-11)5-12(4-9,6-11)16-8-14-7-15-16/h7-10H,1-6H2/t9-,10+,11?,12?