[4-chloranyl-1-[4-(4-chlorophenyl)phenoxy]-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-yl] ethanoate

Systemtic Name: [4-chloranyl-1-[4-(4-chlorophenyl)phenoxy]-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-yl] ethanoate Openeye Name: [3-chloro-1-[[4-(4-chlorophenyl)phenoxy]-(1,2,4-triazol-1-yl)methyl]-2,2-dimethyl-propyl] acetate CAS Name: acetic acid [4-chloro-1-[4-(4-chlorophenyl)phenoxy]-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-yl] ester IUPAC Name: [4-chloro-1-[4-(4-chlorophenyl)phenoxy]-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-yl] acetate Traditional Name: acetic acid [3-chloro-1-[[4-(4-chlorophenyl)phenoxy]-(1,2,4-triazol-1-yl)methyl]-2,2-dimethyl-propyl] ester Formula: C22H23Cl2N3O3 MolecularWeight: 448.34232

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C(N1C=NC=N1)OC2=CC=C(C=C2)C3=CC=C(C=C3)Cl)C(C)(C)CCl

Isomeric SMILES

CC(=O)OC(C(N1C=NC=N1)OC2=CC=C(C=C2)C3=CC=C(C=C3)Cl)C(C)(C)CCl

InChI

InChI=1S/C22H23Cl2N3O3/c1-15(28)29-20(22(2,3)12-23)21(27-14-25-13-26-27)30-19-10-6-17(7-11-19)16-4-8-18(24)9-5-16/h4-11,13-14,20-21H,12H2,1-3H3