(3S,4aR,8aS)-3-phenylmethoxy-4a,5,8,8a-tetrahydro-1H-isochromen-4-one

Systemtic Name: (3S,4aR,8aS)-3-phenylmethoxy-4a,5,8,8a-tetrahydro-1H-isochromen-4-one Openeye Name: (3S,4aR,8aS)-3-benzyloxy-4a,5,8,8a-tetrahydro-1H-isochromen-4-one CAS Name: (3S,4aR,8aS)-3-phenylmethoxy-4a,5,8,8a-tetrahydro-1H-2-benzopyran-4-one IUPAC Name: (3S,4aR,8aS)-3-phenylmethoxy-4a,5,8,8a-tetrahydro-1H-isochromen-4-one Traditional Name: (3S,4aR,8aS)-3-benzoxy-4a,5,8,8a-tetrahydro-1H-isochromen-4-one Formula: C16H18O3 MolecularWeight: 258.31232

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC2C1COC(C2=O)OCC3=CC=CC=C3

Isomeric SMILES

C1C=CC[C@@H]2[C@H]1CO[C@H](C2=O)OCC3=CC=CC=C3

InChI

InChI=1S/C16H18O3/c17-15-14-9-5-4-8-13(14)11-19-16(15)18-10-12-6-2-1-3-7-12/h1-7,13-14,16H,8-11H2/t13-,14-,16-/m1/s1