4-[(E)-3-(5-chloranyl-2-oxidanyl-phenyl)-3-oxidanylidene-prop-1-enyl]benzoic acid

Systemtic Name: 4-[(E)-3-(5-chloranyl-2-oxidanyl-phenyl)-3-oxidanylidene-prop-1-enyl]benzoic acid Openeye Name: 4-[(E)-3-(5-chloro-2-hydroxy-phenyl)-3-oxo-prop-1-enyl]benzoic acid CAS Name: 4-[(E)-3-(5-chloro-2-hydroxyphenyl)-3-oxoprop-1-enyl]benzoic acid IUPAC Name: 4-[(E)-3-(5-chloro-2-hydroxyphenyl)-3-oxoprop-1-enyl]benzoic acid Traditional Name: 4-[(E)-3-(5-chloro-2-hydroxy-phenyl)-3-keto-prop-1-enyl]benzoic acid Formula: C16H11ClO4 MolecularWeight: 302.70914

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)C2=C(C=CC(=C2)Cl)O)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1/C=C/C(=O)C2=C(C=CC(=C2)Cl)O)C(=O)O

InChI

InChI=1S/C16H11ClO4/c17-12-6-8-15(19)13(9-12)14(18)7-3-10-1-4-11(5-2-10)16(20)21/h1-9,19H,(H,20,21)/b7-3+