(4-propylphenyl) 5-bromanyl-1-benzofuran-2-carboxylate

Systemtic Name: (4-propylphenyl) 5-bromanyl-1-benzofuran-2-carboxylate Openeye Name: (4-propylphenyl) 5-bromobenzofuran-2-carboxylate CAS Name: 5-bromo-2-benzofurancarboxylic acid (4-propylphenyl) ester IUPAC Name: (4-propylphenyl) 5-bromo-1-benzofuran-2-carboxylate Traditional Name: 5-bromocoumarilic acid (4-propylphenyl) ester Formula: C18H15BrO3 MolecularWeight: 359.2139

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)OC(=O)C2=CC3=C(O2)C=CC(=C3)Br

Isomeric SMILES

CCCC1=CC=C(C=C1)OC(=O)C2=CC3=C(O2)C=CC(=C3)Br

InChI

InChI=1S/C18H15BrO3/c1-2-3-12-4-7-15(8-5-12)21-18(20)17-11-13-10-14(19)6-9-16(13)22-17/h4-11H,2-3H2,1H3