[4-(4-chloranylphenoxy)-2-ethyl-2-methyl-3-oxidanylidene-4-(1,2,4-triazol-1-yl)butyl] ethanoate

Systemtic Name: [4-(4-chloranylphenoxy)-2-ethyl-2-methyl-3-oxidanylidene-4-(1,2,4-triazol-1-yl)butyl] ethanoate Openeye Name: [4-(4-chlorophenoxy)-2-ethyl-2-methyl-3-oxo-4-(1,2,4-triazol-1-yl)butyl] acetate CAS Name: acetic acid [4-(4-chlorophenoxy)-2-ethyl-2-methyl-3-oxo-4-(1,2,4-triazol-1-yl)butyl] ester IUPAC Name: [4-(4-chlorophenoxy)-2-ethyl-2-methyl-3-oxo-4-(1,2,4-triazol-1-yl)butyl] acetate Traditional Name: acetic acid [4-(4-chlorophenoxy)-2-ethyl-3-keto-2-methyl-4-(1,2,4-triazol-1-yl)butyl] ester Formula: C17H20ClN3O4 MolecularWeight: 365.8114

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(COC(=O)C)C(=O)C(N1C=NC=N1)OC2=CC=C(C=C2)Cl

Isomeric SMILES

CCC(C)(COC(=O)C)C(=O)C(N1C=NC=N1)OC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H20ClN3O4/c1-4-17(3,9-24-12(2)22)15(23)16(21-11-19-10-20-21)25-14-7-5-13(18)6-8-14/h5-8,10-11,16H,4,9H2,1-3H3