2,2-dimethyl-4-(1,2,4-triazol-1-yl)hept-6-en-3-one

Systemtic Name: 2,2-dimethyl-4-(1,2,4-triazol-1-yl)hept-6-en-3-one Openeye Name: 2,2-dimethyl-4-(1,2,4-triazol-1-yl)hept-6-en-3-one CAS Name: 2,2-dimethyl-4-(1,2,4-triazol-1-yl)-6-hepten-3-one IUPAC Name: 2,2-dimethyl-4-(1,2,4-triazol-1-yl)hept-6-en-3-one Traditional Name: 2,2-dimethyl-4-(1,2,4-triazol-1-yl)hept-6-en-3-one Formula: C11H17N3O MolecularWeight: 207.27218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(CC=C)N1C=NC=N1

Isomeric SMILES

CC(C)(C)C(=O)C(CC=C)N1C=NC=N1

InChI

InChI=1S/C11H17N3O/c1-5-6-9(10(15)11(2,3)4)14-8-12-7-13-14/h5,7-9H,1,6H2,2-4H3