[2-(4-acetamidophenyl)-2-oxidanylidene-ethyl] 3-(2-methylpropoxy)benzoate

Systemtic Name: [2-(4-acetamidophenyl)-2-oxidanylidene-ethyl] 3-(2-methylpropoxy)benzoate Openeye Name: [2-(4-acetamidophenyl)-2-oxo-ethyl] 3-isobutoxybenzoate CAS Name: 3-(2-methylpropoxy)benzoic acid [2-(4-acetamidophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-acetamidophenyl)-2-oxoethyl] 3-(2-methylpropoxy)benzoate Traditional Name: 3-isobutoxybenzoic acid [2-(4-acetamidophenyl)-2-keto-ethyl] ester Formula: C21H23NO5 MolecularWeight: 369.41102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=CC(=C1)C(=O)OCC(=O)C2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CC(C)COC1=CC=CC(=C1)C(=O)OCC(=O)C2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C21H23NO5/c1-14(2)12-26-19-6-4-5-17(11-19)21(25)27-13-20(24)16-7-9-18(10-8-16)22-15(3)23/h4-11,14H,12-13H2,1-3H3,(H,22,23)