3-[1-(3-carboxy-5-chloranyl-2-oxidanyl-phenyl)but-1-enyl]-5-chloranyl-2-oxidanyl-benzoic acid

Systemtic Name: 3-[1-(3-carboxy-5-chloranyl-2-oxidanyl-phenyl)but-1-enyl]-5-chloranyl-2-oxidanyl-benzoic acid Openeye Name: 3-[1-(3-carboxy-5-chloro-2-hydroxy-phenyl)but-1-enyl]-5-chloro-2-hydroxy-benzoic acid CAS Name: 3-[1-(3-carboxy-5-chloro-2-hydroxyphenyl)but-1-enyl]-5-chloro-2-hydroxybenzoic acid IUPAC Name: 3-[1-(3-carboxy-5-chloro-2-hydroxyphenyl)but-1-enyl]-5-chloro-2-hydroxybenzoic acid Traditional Name: 3-[1-(3-carboxy-5-chloro-2-hydroxy-phenyl)but-1-enyl]-5-chloro-2-hydroxy-benzoic acid Formula: C18H14Cl2O6 MolecularWeight: 397.20616

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Descriptors Computed from Structure

Canonical SMILES:

CCC=C(C1=CC(=CC(=C1O)C(=O)O)Cl)C2=CC(=CC(=C2O)C(=O)O)Cl

Isomeric SMILES

CCC=C(C1=CC(=CC(=C1O)C(=O)O)Cl)C2=CC(=CC(=C2O)C(=O)O)Cl

InChI

InChI=1S/C18H14Cl2O6/c1-2-3-10(11-4-8(19)6-13(15(11)21)17(23)24)12-5-9(20)7-14(16(12)22)18(25)26/h3-7,21-22H,2H2,1H3,(H,23,24)(H,25,26)