4-[(4-bromanyl-2,3-dimethyl-phenoxy)methyl]-5-methyl-furan-2-carboxylate

Systemtic Name: 4-[(4-bromanyl-2,3-dimethyl-phenoxy)methyl]-5-methyl-furan-2-carboxylate Openeye Name: 4-[(4-bromo-2,3-dimethyl-phenoxy)methyl]-5-methyl-furan-2-carboxylate CAS Name: 4-[(4-bromo-2,3-dimethylphenoxy)methyl]-5-methyl-2-furancarboxylate IUPAC Name: 4-[(4-bromo-2,3-dimethylphenoxy)methyl]-5-methylfuran-2-carboxylate Traditional Name: 4-[(4-bromo-2,3-dimethyl-phenoxy)methyl]-5-methyl-2-furoate Formula: C15H14BrO4- MolecularWeight: 338.17326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C)Br)OCC2=C(OC(=C2)C(=O)[O-])C

Isomeric SMILES

CC1=C(C=CC(=C1C)Br)OCC2=C(OC(=C2)C(=O)[O-])C

InChI

InChI=1S/C15H15BrO4/c1-8-9(2)13(5-4-12(8)16)19-7-11-6-14(15(17)18)20-10(11)3/h4-6H,7H2,1-3H3,(H,17,18)/p-1