2-[6-bromanyl-4-oxidanylidene-2-(4-phenylphenyl)chromen-3-yl]oxyethanoic acid

Systemtic Name: 2-[6-bromanyl-4-oxidanylidene-2-(4-phenylphenyl)chromen-3-yl]oxyethanoic acid Openeye Name: 2-[6-bromo-4-oxo-2-(4-phenylphenyl)chromen-3-yl]oxyacetic acid CAS Name: 2-[[6-bromo-4-oxo-2-(4-phenylphenyl)-1-benzopyran-3-yl]oxy]acetic acid IUPAC Name: 2-[6-bromo-4-oxo-2-(4-phenylphenyl)chromen-3-yl]oxyacetic acid Traditional Name: 2-[6-bromo-4-keto-2-(4-phenylphenyl)chromen-3-yl]oxyacetic acid Formula: C23H15BrO5 MolecularWeight: 451.2662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=C(C(=O)C4=C(O3)C=CC(=C4)Br)OCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=C(C(=O)C4=C(O3)C=CC(=C4)Br)OCC(=O)O

InChI

InChI=1S/C23H15BrO5/c24-17-10-11-19-18(12-17)21(27)23(28-13-20(25)26)22(29-19)16-8-6-15(7-9-16)14-4-2-1-3-5-14/h1-12H,13H2,(H,25,26)