(3S,8R,8aS)-3,8a-dimethyl-8-phenyl-4,6,7,8-tetrahydro-3H-isochromen-1-one

Systemtic Name: (3S,8R,8aS)-3,8a-dimethyl-8-phenyl-4,6,7,8-tetrahydro-3H-isochromen-1-one Openeye Name: (3S,8R,8aS)-3,8a-dimethyl-8-phenyl-4,6,7,8-tetrahydro-3H-isochromen-1-one CAS Name: (3S,8R,8aS)-3,8a-dimethyl-8-phenyl-4,6,7,8-tetrahydro-3H-2-benzopyran-1-one IUPAC Name: (3S,8R,8aS)-3,8a-dimethyl-8-phenyl-4,6,7,8-tetrahydro-3H-isochromen-1-one Traditional Name: (3S,8R,8aS)-3,8a-dimethyl-8-phenyl-4,6,7,8-tetrahydro-3H-isochromen-1-one Formula: C17H20O2 MolecularWeight: 256.3395

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CCCC(C2(C(=O)O1)C)C3=CC=CC=C3

Isomeric SMILES

C[C@H]1CC2=CCC[C@@H]([C@@]2(C(=O)O1)C)C3=CC=CC=C3

InChI

InChI=1S/C17H20O2/c1-12-11-14-9-6-10-15(13-7-4-3-5-8-13)17(14,2)16(18)19-12/h3-5,7-9,12,15H,6,10-11H2,1-2H3/t12-,15+,17+/m0/s1