4-[(E)-5-(4-carboxyphenyl)-1,5-bis(oxidanyl)pent-3-enyl]benzoic acid

Systemtic Name: 4-[(E)-5-(4-carboxyphenyl)-1,5-bis(oxidanyl)pent-3-enyl]benzoic acid Openeye Name: 4-[(E)-5-(4-carboxyphenyl)-1,5-dihydroxy-pent-3-enyl]benzoic acid CAS Name: 4-[(E)-5-(4-carboxyphenyl)-1,5-dihydroxypent-3-enyl]benzoic acid IUPAC Name: 4-[(E)-5-(4-carboxyphenyl)-1,5-dihydroxypent-3-enyl]benzoic acid Traditional Name: 4-[(E)-5-(4-carboxyphenyl)-1,5-dihydroxy-pent-3-enyl]benzoic acid Formula: C19H18O6 MolecularWeight: 342.34262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18O6/c20-16(12-4-8-14(9-5-12)18(22)23)2-1-3-17(21)13-6-10-15(11-7-13)19(24)25/h1-2,4-11,16-17,20-21H,3H2,(H,22,23)(H,24,25)/b2-1+