4-[(E)-(6-bromanyl-4-oxidanylidene-chromen-3-ylidene)methyl]benzoic acid

Systemtic Name: 4-[(E)-(6-bromanyl-4-oxidanylidene-chromen-3-ylidene)methyl]benzoic acid Openeye Name: 4-[(E)-(6-bromo-4-oxo-chroman-3-ylidene)methyl]benzoic acid CAS Name: 4-[(E)-(6-bromo-4-oxo-3,4-dihydro-2H-1-benzopyran-3-ylidene)methyl]benzoic acid IUPAC Name: 4-[(E)-(6-bromo-4-oxochromen-3-ylidene)methyl]benzoic acid Traditional Name: 4-[(E)-(6-bromo-4-keto-chroman-3-ylidene)methyl]benzoic acid Formula: C17H11BrO4 MolecularWeight: 359.17084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC2=CC=C(C=C2)C(=O)O)C(=O)C3=C(O1)C=CC(=C3)Br

Isomeric SMILES

C1/C(=C\C2=CC=C(C=C2)C(=O)O)/C(=O)C3=C(O1)C=CC(=C3)Br

InChI

InChI=1S/C17H11BrO4/c18-13-5-6-15-14(8-13)16(19)12(9-22-15)7-10-1-3-11(4-2-10)17(20)21/h1-8H,9H2,(H,20,21)/b12-7+