4-[[3-[(4-carboxyphenyl)methylidene]-2-oxidanylidene-cyclohexylidene]methyl]benzoic acid

Systemtic Name: 4-[[3-[(4-carboxyphenyl)methylidene]-2-oxidanylidene-cyclohexylidene]methyl]benzoic acid Openeye Name: 4-[[3-[(4-carboxyphenyl)methylene]-2-oxo-cyclohexylidene]methyl]benzoic acid CAS Name: 4-[[3-[(4-carboxyphenyl)methylidene]-2-oxocyclohexylidene]methyl]benzoic acid IUPAC Name: 4-[[3-[(4-carboxyphenyl)methylidene]-2-oxocyclohexylidene]methyl]benzoic acid Traditional Name: 4-[[3-(4-carboxybenzylidene)-2-keto-cyclohexylidene]methyl]benzoic acid Formula: C22H18O5 MolecularWeight: 362.37532

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC2=CC=C(C=C2)C(=O)O)C(=O)C(=CC3=CC=C(C=C3)C(=O)O)C1

Isomeric SMILES

C1CC(=CC2=CC=C(C=C2)C(=O)O)C(=O)C(=CC3=CC=C(C=C3)C(=O)O)C1

InChI

InChI=1S/C22H18O5/c23-20-18(12-14-4-8-16(9-5-14)21(24)25)2-1-3-19(20)13-15-6-10-17(11-7-15)22(26)27/h4-13H,1-3H2,(H,24,25)(H,26,27)