(1S,4S,4aR,8aR)-1-methoxy-1,8a-dimethyl-4-oxidanyl-3,4,4a,5-tetrahydroisochromen-6-one

Systemtic Name: (1S,4S,4aR,8aR)-1-methoxy-1,8a-dimethyl-4-oxidanyl-3,4,4a,5-tetrahydroisochromen-6-one Openeye Name: (1S,4S,4aR,8aR)-4-hydroxy-1-methoxy-1,8a-dimethyl-3,4,4a,5-tetrahydroisochromen-6-one CAS Name: (1S,4S,4aR,8aR)-4-hydroxy-1-methoxy-1,8a-dimethyl-3,4,4a,5-tetrahydro-2-benzopyran-6-one IUPAC Name: (1S,4S,4aR,8aR)-4-hydroxy-1-methoxy-1,8a-dimethyl-3,4,4a,5-tetrahydroisochromen-6-one Traditional Name: (1S,4S,4aR,8aR)-4-hydroxy-1-methoxy-1,8a-dimethyl-3,4,4a,5-tetrahydroisochromen-6-one Formula: C12H18O4 MolecularWeight: 226.26892

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Descriptors Computed from Structure

Canonical SMILES:

CC12C=CC(=O)CC1C(COC2(C)OC)O

Isomeric SMILES

C[C@@]12C=CC(=O)C[C@H]1[C@@H](CO[C@]2(C)OC)O

InChI

InChI=1S/C12H18O4/c1-11-5-4-8(13)6-9(11)10(14)7-16-12(11,2)15-3/h4-5,9-10,14H,6-7H2,1-3H3/t9-,10+,11+,12-/m0/s1