ethyl 4-(4-chloranylphenoxy)-3-ethoxy-2-ethyl-2-methyl-4-(1,2,4-triazol-1-yl)butanoate

Systemtic Name: ethyl 4-(4-chloranylphenoxy)-3-ethoxy-2-ethyl-2-methyl-4-(1,2,4-triazol-1-yl)butanoate Openeye Name: ethyl 4-(4-chlorophenoxy)-3-ethoxy-2-ethyl-2-methyl-4-(1,2,4-triazol-1-yl)butanoate CAS Name: 4-(4-chlorophenoxy)-3-ethoxy-2-ethyl-2-methyl-4-(1,2,4-triazol-1-yl)butanoic acid ethyl ester IUPAC Name: ethyl 4-(4-chlorophenoxy)-3-ethoxy-2-ethyl-2-methyl-4-(1,2,4-triazol-1-yl)butanoate Traditional Name: 4-(4-chlorophenoxy)-3-ethoxy-2-ethyl-2-methyl-4-(1,2,4-triazol-1-yl)butyric acid ethyl ester Formula: C19H26ClN3O4 MolecularWeight: 395.88044

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26ClN3O4/c1-5-19(4,18(24)26-7-3)16(25-6-2)17(23-13-21-12-22-23)27-15-10-8-14(20)9-11-15/h8-13,16-17H,5-7H2,1-4H3