(3R,4aS,8aR)-3-phenyl-3,4,4a,7,8,8a-hexahydroisochromen-1-one

Systemtic Name: (3R,4aS,8aR)-3-phenyl-3,4,4a,7,8,8a-hexahydroisochromen-1-one Openeye Name: (3R,4aS,8aR)-3-phenyl-3,4,4a,7,8,8a-hexahydroisochromen-1-one CAS Name: (3R,4aS,8aR)-3-phenyl-3,4,4a,7,8,8a-hexahydro-2-benzopyran-1-one IUPAC Name: (3R,4aS,8aR)-3-phenyl-3,4,4a,7,8,8a-hexahydroisochromen-1-one Traditional Name: (3R,4aS,8aR)-3-phenyl-3,4,4a,7,8,8a-hexahydroisochromen-1-one Formula: C15H16O2 MolecularWeight: 228.28634

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(CC(OC2=O)C3=CC=CC=C3)C=C1

Isomeric SMILES

C1C[C@@H]2[C@@H](C[C@@H](OC2=O)C3=CC=CC=C3)C=C1

InChI

InChI=1S/C15H16O2/c16-15-13-9-5-4-8-12(13)10-14(17-15)11-6-2-1-3-7-11/h1-4,6-8,12-14H,5,9-10H2/t12-,13-,14-/m1/s1