5-[(2-bromanyl-6-tert-butyl-4-methoxy-phenoxy)methyl]furan-2-carboxylic acid

Systemtic Name: 5-[(2-bromanyl-6-tert-butyl-4-methoxy-phenoxy)methyl]furan-2-carboxylic acid Openeye Name: 5-[(2-bromo-6-tert-butyl-4-methoxy-phenoxy)methyl]furan-2-carboxylic acid CAS Name: 5-[(2-bromo-6-tert-butyl-4-methoxyphenoxy)methyl]-2-furancarboxylic acid IUPAC Name: 5-[(2-bromo-6-tert-butyl-4-methoxyphenoxy)methyl]furan-2-carboxylic acid Traditional Name: 5-[(2-bromo-6-tert-butyl-4-methoxy-phenoxy)methyl]-2-furoic acid Formula: C17H19BrO5 MolecularWeight: 383.23376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1OCC2=CC=C(O2)C(=O)O)Br)OC

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1OCC2=CC=C(O2)C(=O)O)Br)OC

InChI

InChI=1S/C17H19BrO5/c1-17(2,3)12-7-11(21-4)8-13(18)15(12)22-9-10-5-6-14(23-10)16(19)20/h5-8H,9H2,1-4H3,(H,19,20)