7-tert-butyl-5-phenyl-4,5-dihydrooxepin-3-one

Systemtic Name: 7-tert-butyl-5-phenyl-4,5-dihydrooxepin-3-one Openeye Name: 7-tert-butyl-5-phenyl-4,5-dihydrooxepin-3-one CAS Name: 7-tert-butyl-5-phenyl-4,5-dihydrooxepin-3-one IUPAC Name: 7-tert-butyl-5-phenyl-4,5-dihydrooxepin-3-one Traditional Name: 7-tert-butyl-5-phenyl-4,5-dihydrooxepin-3-one Formula: C16H20O2 MolecularWeight: 244.3288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(CC(=O)CO1)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1=CC(CC(=O)CO1)C2=CC=CC=C2

InChI

InChI=1S/C16H20O2/c1-16(2,3)15-10-13(9-14(17)11-18-15)12-7-5-4-6-8-12/h4-8,10,13H,9,11H2,1-3H3