(3aS,4S,7aS)-7a-methyl-4-phenyl-3,3a,4,7-tetrahydro-2-benzofuran-1-one

Systemtic Name: (3aS,4S,7aS)-7a-methyl-4-phenyl-3,3a,4,7-tetrahydro-2-benzofuran-1-one Openeye Name: (3aS,4S,7aS)-7a-methyl-4-phenyl-3,3a,4,7-tetrahydroisobenzofuran-1-one CAS Name: (3aS,4S,7aS)-7a-methyl-4-phenyl-3,3a,4,7-tetrahydroisobenzofuran-1-one IUPAC Name: (3aS,4S,7aS)-7a-methyl-4-phenyl-3,3a,4,7-tetrahydro-2-benzofuran-1-one Traditional Name: (3aS,4S,7aS)-7a-methyl-4-phenyl-3,3a,4,7-tetrahydroisobenzofuran-1-one Formula: C15H16O2 MolecularWeight: 228.28634

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC=CC(C1COC2=O)C3=CC=CC=C3

Isomeric SMILES

C[C@]12CC=C[C@@H]([C@@H]1COC2=O)C3=CC=CC=C3

InChI

InChI=1S/C15H16O2/c1-15-9-5-8-12(11-6-3-2-4-7-11)13(15)10-17-14(15)16/h2-8,12-13H,9-10H2,1H3/t12-,13+,15+/m1/s1