ethyl (4aR,9bS)-4-oxidanylidene-1-phenyl-2,3,4a,9b-tetrahydro-1H-dibenzofuran-3-carboxylate

Systemtic Name: ethyl (4aR,9bS)-4-oxidanylidene-1-phenyl-2,3,4a,9b-tetrahydro-1H-dibenzofuran-3-carboxylate Openeye Name: ethyl (4aR,9bS)-4-oxo-1-phenyl-2,3,4a,9b-tetrahydro-1H-dibenzofuran-3-carboxylate CAS Name: (4aR,9bS)-4-oxo-1-phenyl-2,3,4a,9b-tetrahydro-1H-dibenzofuran-3-carboxylic acid ethyl ester IUPAC Name: ethyl (4aR,9bS)-4-oxo-1-phenyl-2,3,4a,9b-tetrahydro-1H-dibenzofuran-3-carboxylate Traditional Name: (4aR,9bS)-4-keto-1-phenyl-2,3,4a,9b-tetrahydro-1H-dibenzofuran-3-carboxylic acid ethyl ester Formula: C21H20O4 MolecularWeight: 336.3811

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(C2C(C1=O)OC3=CC=CC=C23)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1CC([C@@H]2[C@H](C1=O)OC3=CC=CC=C23)C4=CC=CC=C4

InChI

InChI=1S/C21H20O4/c1-2-24-21(23)16-12-15(13-8-4-3-5-9-13)18-14-10-6-7-11-17(14)25-20(18)19(16)22/h3-11,15-16,18,20H,2,12H2,1H3/t15?,16?,18-,20-/m1/s1