tert-butyl (2E)-2-[(4-chlorophenyl)methylidene]-3-oxidanylidene-butanoate

Systemtic Name: tert-butyl (2E)-2-[(4-chlorophenyl)methylidene]-3-oxidanylidene-butanoate Openeye Name: tert-butyl (2E)-2-[(4-chlorophenyl)methylene]-3-oxo-butanoate CAS Name: (2E)-2-[(4-chlorophenyl)methylidene]-3-oxobutanoic acid tert-butyl ester IUPAC Name: tert-butyl (2E)-2-[(4-chlorophenyl)methylidene]-3-oxobutanoate Traditional Name: (E)-2-acetyl-3-(4-chlorophenyl)acrylic acid tert-butyl ester Formula: C15H17ClO3 MolecularWeight: 280.74668

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC=C(C=C1)Cl)C(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)/C(=C\C1=CC=C(C=C1)Cl)/C(=O)OC(C)(C)C

InChI

InChI=1S/C15H17ClO3/c1-10(17)13(14(18)19-15(2,3)4)9-11-5-7-12(16)8-6-11/h5-9H,1-4H3/b13-9+