(3S,4R)-4-methyl-3-oxidanyl-3-phenyl-4,5-dihydrooxepin-2-one

Systemtic Name: (3S,4R)-4-methyl-3-oxidanyl-3-phenyl-4,5-dihydrooxepin-2-one Openeye Name: (3S,4R)-3-hydroxy-4-methyl-3-phenyl-4,5-dihydrooxepin-2-one CAS Name: (3S,4R)-3-hydroxy-4-methyl-3-phenyl-4,5-dihydrooxepin-2-one IUPAC Name: (3S,4R)-3-hydroxy-4-methyl-3-phenyl-4,5-dihydrooxepin-2-one Traditional Name: (3S,4R)-3-hydroxy-4-methyl-3-phenyl-4,5-dihydrooxepin-2-one Formula: C13H14O3 MolecularWeight: 218.24846

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC=COC(=O)C1(C2=CC=CC=C2)O

Isomeric SMILES

C[C@@H]1CC=COC(=O)[C@]1(C2=CC=CC=C2)O

InChI

InChI=1S/C13H14O3/c1-10-6-5-9-16-12(14)13(10,15)11-7-3-2-4-8-11/h2-5,7-10,15H,6H2,1H3/t10-,13+/m1/s1