5-[(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)methyl]furan-2-carboxylate

Systemtic Name: 5-[(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)methyl]furan-2-carboxylate Openeye Name: 5-[(4-bromo-2-isopropyl-5-methyl-phenoxy)methyl]furan-2-carboxylate CAS Name: 5-[(4-bromo-5-methyl-2-propan-2-ylphenoxy)methyl]-2-furancarboxylate IUPAC Name: 5-[(4-bromo-5-methyl-2-propan-2-ylphenoxy)methyl]furan-2-carboxylate Traditional Name: 5-[(4-bromo-2-isopropyl-5-methyl-phenoxy)methyl]-2-furoate Formula: C16H16BrO4- MolecularWeight: 352.19984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C(C)C)OCC2=CC=C(O2)C(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1Br)C(C)C)OCC2=CC=C(O2)C(=O)[O-]

InChI

InChI=1S/C16H17BrO4/c1-9(2)12-7-13(17)10(3)6-15(12)20-8-11-4-5-14(21-11)16(18)19/h4-7,9H,8H2,1-3H3,(H,18,19)/p-1