2-(4-cyanophenyl)-3-[(2-methylpropan-2-yl)oxy]-3-oxidanylidene-propanoic acid

Systemtic Name: 2-(4-cyanophenyl)-3-[(2-methylpropan-2-yl)oxy]-3-oxidanylidene-propanoic acid Openeye Name: 3-tert-butoxy-2-(4-cyanophenyl)-3-oxo-propanoic acid CAS Name: 2-(4-cyanophenyl)-3-[(2-methylpropan-2-yl)oxy]-3-oxopropanoic acid IUPAC Name: 2-(4-cyanophenyl)-3-[(2-methylpropan-2-yl)oxy]-3-oxopropanoic acid Traditional Name: 3-tert-butoxy-2-(4-cyanophenyl)-3-keto-propionic acid Formula: C14H15NO4 MolecularWeight: 261.2732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C1=CC=C(C=C1)C#N)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)C(C1=CC=C(C=C1)C#N)C(=O)O

InChI

InChI=1S/C14H15NO4/c1-14(2,3)19-13(18)11(12(16)17)10-6-4-9(8-15)5-7-10/h4-7,11H,1-3H3,(H,16,17)