1,3-benzodioxol-5-yl 5-bromanyl-3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: 1,3-benzodioxol-5-yl 5-bromanyl-3-methyl-1-benzofuran-2-carboxylate Openeye Name: 1,3-benzodioxol-5-yl 5-bromo-3-methyl-benzofuran-2-carboxylate CAS Name: 5-bromo-3-methyl-2-benzofurancarboxylic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 5-bromo-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 5-bromo-3-methyl-coumarilic acid 1,3-benzodioxol-5-yl ester Formula: C17H11BrO5 MolecularWeight: 375.17024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)Br)C(=O)OC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)Br)C(=O)OC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H11BrO5/c1-9-12-6-10(18)2-4-13(12)23-16(9)17(19)22-11-3-5-14-15(7-11)21-8-20-14/h2-7H,8H2,1H3