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

Systemtic Name: (5-ethanoyl-2-methoxy-phenyl)methyl 4-(1,2,4-triazol-1-yl)benzoate Openeye Name: (5-acetyl-2-methoxy-phenyl)methyl 4-(1,2,4-triazol-1-yl)benzoate CAS Name: 4-(1,2,4-triazol-1-yl)benzoic acid (5-acetyl-2-methoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-methoxyphenyl)methyl 4-(1,2,4-triazol-1-yl)benzoate Traditional Name: 4-(1,2,4-triazol-1-yl)benzoic acid (5-acetyl-2-methoxy-benzyl) ester Formula: C19H17N3O4 MolecularWeight: 351.35598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17N3O4/c1-13(23)15-5-8-18(25-2)16(9-15)10-26-19(24)14-3-6-17(7-4-14)22-12-20-11-21-22/h3-9,11-12H,10H2,1-2H3