3-(1H-1,2,4-triazol-5-yliminomethyl)cyclohex-2-en-1-one

Systemtic Name: 3-(1H-1,2,4-triazol-5-yliminomethyl)cyclohex-2-en-1-one Openeye Name: 3-(1H-1,2,4-triazol-5-yliminomethyl)cyclohex-2-en-1-one CAS Name: 3-(1H-1,2,4-triazol-5-yliminomethyl)-1-cyclohex-2-enone IUPAC Name: 3-(1H-1,2,4-triazol-5-yliminomethyl)cyclohex-2-en-1-one Traditional Name: 3-(1H-1,2,4-triazol-5-yliminomethyl)cyclohex-2-en-1-one Formula: C9H10N4O MolecularWeight: 190.2019

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC(=O)C1)C=NC2=NC=NN2

Isomeric SMILES

C1CC(=CC(=O)C1)C=NC2=NC=NN2

InChI

InChI=1S/C9H10N4O/c14-8-3-1-2-7(4-8)5-10-9-11-6-12-13-9/h4-6H,1-3H2,(H,11,12,13)