3-methyl-5-phenyl-1-benzofuran-2-carboxylic acid

Systemtic Name: 3-methyl-5-phenyl-1-benzofuran-2-carboxylic acid Openeye Name: 3-methyl-5-phenyl-benzofuran-2-carboxylic acid CAS Name: 3-methyl-5-phenyl-2-benzofurancarboxylic acid IUPAC Name: 3-methyl-5-phenyl-1-benzofuran-2-carboxylic acid Traditional Name: 3-methyl-5-phenyl-coumarilic acid Formula: C16H12O3 MolecularWeight: 252.26468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12O3/c1-10-13-9-12(11-5-3-2-4-6-11)7-8-14(13)19-15(10)16(17)18/h2-9H,1H3,(H,17,18)