3-[7,8-bis(oxidanyl)-3,4-dihydro-2H-chromen-3-yl]benzoic acid

Systemtic Name: 3-[7,8-bis(oxidanyl)-3,4-dihydro-2H-chromen-3-yl]benzoic acid Openeye Name: 3-(7,8-dihydroxychroman-3-yl)benzoic acid CAS Name: 3-(7,8-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl)benzoic acid IUPAC Name: 3-(7,8-dihydroxy-3,4-dihydro-2H-chromen-3-yl)benzoic acid Traditional Name: 3-(7,8-dihydroxychroman-3-yl)benzoic acid Formula: C16H14O5 MolecularWeight: 286.27936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(COC2=C1C=CC(=C2O)O)C3=CC=CC(=C3)C(=O)O

Isomeric SMILES

C1C(COC2=C1C=CC(=C2O)O)C3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C16H14O5/c17-13-5-4-10-7-12(8-21-15(10)14(13)18)9-2-1-3-11(6-9)16(19)20/h1-6,12,17-18H,7-8H2,(H,19,20)