[2-(4-hydroxyphenyl)-3,7-bis(oxidanyl)chromenylium-5-yl] benzoate chloride

Systemtic Name: [2-(4-hydroxyphenyl)-3,7-bis(oxidanyl)chromenylium-5-yl] benzoate chloride Openeye Name: [3,7-dihydroxy-2-(4-hydroxyphenyl)chromenylium-5-yl] benzoate chloride CAS Name: benzoic acid [3,7-dihydroxy-2-(4-hydroxyphenyl)-1-benzopyrylium-5-yl] ester chloride IUPAC Name: [3,7-dihydroxy-2-(4-hydroxyphenyl)chromenylium-5-yl] benzoate chloride Traditional Name: benzoic acid [3,7-dihydroxy-2-(4-hydroxyphenyl)-1-benzopyrylium-5-yl] ester chloride Formula: C22H15ClO6 MolecularWeight: 410.8039

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC2=CC(=CC3=[O+]C(=C(C=C23)O)C4=CC=C(C=C4)O)O.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC2=CC(=CC3=[O+]C(=C(C=C23)O)C4=CC=C(C=C4)O)O.[Cl-]

InChI

InChI=1S/C22H14O6.ClH/c23-15-8-6-13(7-9-15)21-18(25)12-17-19(27-21)10-16(24)11-20(17)28-22(26)14-4-2-1-3-5-14;/h1-12H,(H2-,23,24,25);1H