phenacyl 5-bromanyl-3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: phenacyl 5-bromanyl-3-methyl-1-benzofuran-2-carboxylate Openeye Name: phenacyl 5-bromo-3-methyl-benzofuran-2-carboxylate CAS Name: 5-bromo-3-methyl-2-benzofurancarboxylic acid phenacyl ester IUPAC Name: phenacyl 5-bromo-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 5-bromo-3-methyl-coumarilic acid phenacyl ester Formula: C18H13BrO4 MolecularWeight: 373.19742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)Br)C(=O)OCC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)Br)C(=O)OCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H13BrO4/c1-11-14-9-13(19)7-8-16(14)23-17(11)18(21)22-10-15(20)12-5-3-2-4-6-12/h2-9H,10H2,1H3