methyl 6-bromanyl-2-methyl-5-phenylmethoxy-1-benzofuran-3-carboxylate

Systemtic Name: methyl 6-bromanyl-2-methyl-5-phenylmethoxy-1-benzofuran-3-carboxylate Openeye Name: methyl 5-benzyloxy-6-bromo-2-methyl-benzofuran-3-carboxylate CAS Name: 6-bromo-2-methyl-5-phenylmethoxy-3-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 6-bromo-2-methyl-5-phenylmethoxy-1-benzofuran-3-carboxylate Traditional Name: 5-benzoxy-6-bromo-2-methyl-benzofuran-3-carboxylic acid methyl ester Formula: C18H15BrO4 MolecularWeight: 375.2133

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC(=C(C=C2O1)Br)OCC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C(C2=CC(=C(C=C2O1)Br)OCC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C18H15BrO4/c1-11-17(18(20)21-2)13-8-16(14(19)9-15(13)23-11)22-10-12-6-4-3-5-7-12/h3-9H,10H2,1-2H3