4-[(3-bromanylphenoxy)methyl]-5-methyl-furan-2-carboxylate

Systemtic Name: 4-[(3-bromanylphenoxy)methyl]-5-methyl-furan-2-carboxylate Openeye Name: 4-[(3-bromophenoxy)methyl]-5-methyl-furan-2-carboxylate CAS Name: 4-[(3-bromophenoxy)methyl]-5-methyl-2-furancarboxylate IUPAC Name: 4-[(3-bromophenoxy)methyl]-5-methylfuran-2-carboxylate Traditional Name: 4-[(3-bromophenoxy)methyl]-5-methyl-2-furoate Formula: C13H10BrO4- MolecularWeight: 310.1201

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C(=O)[O-])COC2=CC(=CC=C2)Br

Isomeric SMILES

CC1=C(C=C(O1)C(=O)[O-])COC2=CC(=CC=C2)Br

InChI

InChI=1S/C13H11BrO4/c1-8-9(5-12(18-8)13(15)16)7-17-11-4-2-3-10(14)6-11/h2-6H,7H2,1H3,(H,15,16)/p-1