(5-ethanoyl-2-ethoxy-phenyl)methyl 4-(1,2,4-triazol-1-yl)benzoate

Systemtic Name: (5-ethanoyl-2-ethoxy-phenyl)methyl 4-(1,2,4-triazol-1-yl)benzoate Openeye Name: (5-acetyl-2-ethoxy-phenyl)methyl 4-(1,2,4-triazol-1-yl)benzoate CAS Name: 4-(1,2,4-triazol-1-yl)benzoic acid (5-acetyl-2-ethoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-ethoxyphenyl)methyl 4-(1,2,4-triazol-1-yl)benzoate Traditional Name: 4-(1,2,4-triazol-1-yl)benzoic acid (5-acetyl-2-ethoxy-benzyl) ester Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)C2=CC=C(C=C2)N3C=NC=N3

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)C2=CC=C(C=C2)N3C=NC=N3

InChI

InChI=1S/C20H19N3O4/c1-3-26-19-9-6-16(14(2)24)10-17(19)11-27-20(25)15-4-7-18(8-5-15)23-13-21-12-22-23/h4-10,12-13H,3,11H2,1-2H3