4-(1-ethynylcyclohexyl)-1H-1,2,4-triazol-5-one

Systemtic Name: 4-(1-ethynylcyclohexyl)-1H-1,2,4-triazol-5-one Openeye Name: 4-(1-ethynylcyclohexyl)-1H-1,2,4-triazol-5-one CAS Name: 4-(1-ethynylcyclohexyl)-1H-1,2,4-triazol-5-one IUPAC Name: 4-(1-ethynylcyclohexyl)-1H-1,2,4-triazol-5-one Traditional Name: 4-(1-ethynylcyclohexyl)-1H-1,2,4-triazol-5-one Formula: C10H13N3O MolecularWeight: 191.22972

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1(CCCCC1)N2C=NNC2=O

Isomeric SMILES

C#CC1(CCCCC1)N2C=NNC2=O

InChI

InChI=1S/C10H13N3O/c1-2-10(6-4-3-5-7-10)13-8-11-12-9(13)14/h1,8H,3-7H2,(H,12,14)