(3E)-3-[(2-chlorophenyl)methylidene]-4-oxidanylidene-pentanoic acid

Systemtic Name: (3E)-3-[(2-chlorophenyl)methylidene]-4-oxidanylidene-pentanoic acid Openeye Name: (3E)-3-[(2-chlorophenyl)methylene]-4-oxo-pentanoic acid CAS Name: (3E)-3-[(2-chlorophenyl)methylidene]-4-oxopentanoic acid IUPAC Name: (3E)-3-[(2-chlorophenyl)methylidene]-4-oxopentanoic acid Traditional Name: (E)-3-acetyl-4-(2-chlorophenyl)but-3-enoic acid Formula: C12H11ClO3 MolecularWeight: 238.66694

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC=CC=C1Cl)CC(=O)O

Isomeric SMILES

CC(=O)/C(=C/C1=CC=CC=C1Cl)/CC(=O)O

InChI

InChI=1S/C12H11ClO3/c1-8(14)10(7-12(15)16)6-9-4-2-3-5-11(9)13/h2-6H,7H2,1H3,(H,15,16)/b10-6+