ethyl 3-oxidanyl-3-phenyl-2H-1-benzofuran-2-carboxylate; 3-phenyl-2H-1-benzofuran-3-ol

Systemtic Name: ethyl 3-oxidanyl-3-phenyl-2H-1-benzofuran-2-carboxylate; 3-phenyl-2H-1-benzofuran-3-ol Openeye Name: ethyl 3-hydroxy-3-phenyl-2H-benzofuran-2-carboxylate; 3-phenyl-2H-benzofuran-3-ol CAS Name: 3-hydroxy-3-phenyl-2H-benzofuran-2-carboxylic acid ethyl ester; 3-phenyl-2H-benzofuran-3-ol IUPAC Name: ethyl 3-hydroxy-3-phenyl-2H-1-benzofuran-2-carboxylate; 3-phenyl-2H-1-benzofuran-3-ol Traditional Name: 3-hydroxy-3-phenyl-coumaran-2-carboxylic acid ethyl ester; 3-phenylcoumaran-3-ol Formula: C45H40O8 MolecularWeight: 708.7943

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C2=CC=CC=C2O1)(C3=CC=CC=C3)O.C1C(C2=CC=CC=C2O1)(C3=CC=CC=C3)O.C1C(C2=CC=CC=C2O1)(C3=CC=CC=C3)O

Isomeric SMILES

CCOC(=O)C1C(C2=CC=CC=C2O1)(C3=CC=CC=C3)O.C1C(C2=CC=CC=C2O1)(C3=CC=CC=C3)O.C1C(C2=CC=CC=C2O1)(C3=CC=CC=C3)O

InChI

InChI=1S/C17H16O4.2C14H12O2/c1-2-20-16(18)15-17(19,12-8-4-3-5-9-12)13-10-6-7-11-14(13)21-15;2*15-14(11-6-2-1-3-7-11)10-16-13-9-5-4-8-12(13)14/h3-11,15,19H,2H2,1H3;2*1-9,15H,10H2