3-(1-adamantyl)-1,4-dihydropyrazol-5-one

Systemtic Name: 3-(1-adamantyl)-1,4-dihydropyrazol-5-one Openeye Name: 3-(1-adamantyl)-1,4-dihydropyrazol-5-one CAS Name: 3-(1-adamantyl)-1,4-dihydropyrazol-5-one IUPAC Name: 3-(1-adamantyl)-1,4-dihydropyrazol-5-one Traditional Name: 5-(1-adamantyl)-2-pyrazolin-3-one Formula: C13H18N2O MolecularWeight: 218.29482

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=NNC(=O)C4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=NNC(=O)C4

InChI

InChI=1S/C13H18N2O/c16-12-4-11(14-15-12)13-5-8-1-9(6-13)3-10(2-8)7-13/h8-10H,1-7H2,(H,15,16)