(1R,3S,4S)-5-bromanyl-8-methoxy-1,3-dimethyl-3,4-dihydro-1H-isochromen-4-ol

Systemtic Name: (1R,3S,4S)-5-bromanyl-8-methoxy-1,3-dimethyl-3,4-dihydro-1H-isochromen-4-ol Openeye Name: (1R,3S,4S)-5-bromo-8-methoxy-1,3-dimethyl-isochroman-4-ol CAS Name: (1R,3S,4S)-5-bromo-8-methoxy-1,3-dimethyl-3,4-dihydro-1H-2-benzopyran-4-ol IUPAC Name: (1R,3S,4S)-5-bromo-8-methoxy-1,3-dimethyl-3,4-dihydro-1H-isochromen-4-ol Traditional Name: (1R,3S,4S)-5-bromo-8-methoxy-1,3-dimethyl-isochroman-4-ol Formula: C12H15BrO3 MolecularWeight: 287.1497

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C2=C(C=CC(=C2C(O1)C)OC)Br)O

Isomeric SMILES

C[C@H]1[C@H](C2=C(C=CC(=C2[C@H](O1)C)OC)Br)O

InChI

InChI=1S/C12H15BrO3/c1-6-10-9(15-3)5-4-8(13)11(10)12(14)7(2)16-6/h4-7,12,14H,1-3H3/t6-,7+,12-/m1/s1