1-(4-ethanoylphenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one

Systemtic Name: 1-(4-ethanoylphenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one Openeye Name: 1-(4-acetylphenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one CAS Name: 1-(4-acetylphenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)-2-butanone IUPAC Name: 1-(4-acetylphenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one Traditional Name: 1-(4-acetylphenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one Formula: C16H19N3O3 MolecularWeight: 301.34036

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OC(C(=O)C(C)(C)C)N2C=NC=N2

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OC(C(=O)C(C)(C)C)N2C=NC=N2

InChI

InChI=1S/C16H19N3O3/c1-11(20)12-5-7-13(8-6-12)22-15(14(21)16(2,3)4)19-10-17-9-18-19/h5-10,15H,1-4H3