(2E)-4-chloranyl-3-oxidanylidene-2-[(2,4,6-trimethylphenyl)methylidene]butanoic acid

Systemtic Name: (2E)-4-chloranyl-3-oxidanylidene-2-[(2,4,6-trimethylphenyl)methylidene]butanoic acid Openeye Name: (2E)-4-chloro-3-oxo-2-[(2,4,6-trimethylphenyl)methylene]butanoic acid CAS Name: (2E)-4-chloro-3-oxo-2-[(2,4,6-trimethylphenyl)methylidene]butanoic acid IUPAC Name: (2E)-4-chloro-3-oxo-2-[(2,4,6-trimethylphenyl)methylidene]butanoic acid Traditional Name: (E)-2-(2-chloroacetyl)-3-mesityl-acrylic acid Formula: C14H15ClO3 MolecularWeight: 266.7201

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C=C(C(=O)CCl)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)/C=C(\C(=O)CCl)/C(=O)O)C

InChI

InChI=1S/C14H15ClO3/c1-8-4-9(2)11(10(3)5-8)6-12(14(17)18)13(16)7-15/h4-6H,7H2,1-3H3,(H,17,18)/b12-6+