5-[(3-bromophenyl)methoxy]-2-methyl-1-benzofuran-3-carboxylic acid

Systemtic Name: 5-[(3-bromophenyl)methoxy]-2-methyl-1-benzofuran-3-carboxylic acid Openeye Name: 5-[(3-bromophenyl)methoxy]-2-methyl-benzofuran-3-carboxylic acid CAS Name: 5-[(3-bromophenyl)methoxy]-2-methyl-3-benzofurancarboxylic acid IUPAC Name: 5-[(3-bromophenyl)methoxy]-2-methyl-1-benzofuran-3-carboxylic acid Traditional Name: 5-(3-bromobenzyl)oxy-2-methyl-benzofuran-3-carboxylic acid Formula: C17H13BrO4 MolecularWeight: 361.18672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C=CC(=C2)OCC3=CC(=CC=C3)Br)C(=O)O

Isomeric SMILES

CC1=C(C2=C(O1)C=CC(=C2)OCC3=CC(=CC=C3)Br)C(=O)O

InChI

InChI=1S/C17H13BrO4/c1-10-16(17(19)20)14-8-13(5-6-15(14)22-10)21-9-11-3-2-4-12(18)7-11/h2-8H,9H2,1H3,(H,19,20)