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

Systemtic Name: (5-ethanoyl-2-ethoxy-phenyl)methyl 4-(5-methylpyrazol-1-yl)benzoate Openeye Name: (5-acetyl-2-ethoxy-phenyl)methyl 4-(5-methylpyrazol-1-yl)benzoate CAS Name: 4-(5-methyl-1-pyrazolyl)benzoic acid (5-acetyl-2-ethoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-ethoxyphenyl)methyl 4-(5-methylpyrazol-1-yl)benzoate Traditional Name: 4-(5-methylpyrazol-1-yl)benzoic acid (5-acetyl-2-ethoxy-benzyl) ester Formula: C22H22N2O4 MolecularWeight: 378.42108

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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(=CC=N3)C

Isomeric SMILES

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

InChI

InChI=1S/C22H22N2O4/c1-4-27-21-10-7-18(16(3)25)13-19(21)14-28-22(26)17-5-8-20(9-6-17)24-15(2)11-12-23-24/h5-13H,4,14H2,1-3H3