(3S,4S)-5-chloranyl-7-methoxy-3-methyl-4,6,8-tris(oxidanyl)-3,4-dihydroisochromen-1-one

Systemtic Name: (3S,4S)-5-chloranyl-7-methoxy-3-methyl-4,6,8-tris(oxidanyl)-3,4-dihydroisochromen-1-one Openeye Name: (3S,4S)-5-chloro-4,6,8-trihydroxy-7-methoxy-3-methyl-isochroman-1-one CAS Name: (3S,4S)-5-chloro-4,6,8-trihydroxy-7-methoxy-3-methyl-3,4-dihydro-1H-2-benzopyran-1-one IUPAC Name: (3S,4S)-5-chloro-4,6,8-trihydroxy-7-methoxy-3-methyl-3,4-dihydroisochromen-1-one Traditional Name: (3S,4S)-5-chloro-4,6,8-trihydroxy-7-methoxy-3-methyl-isochroman-1-one Formula: C11H11ClO6 MolecularWeight: 274.65444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(C2=C(C(=C(C(=C2Cl)O)OC)O)C(=O)O1)O

Isomeric SMILES

C[C@H]1[C@H](C2=C(C(=C(C(=C2Cl)O)OC)O)C(=O)O1)O

InChI

InChI=1S/C11H11ClO6/c1-3-7(13)4-5(11(16)18-3)8(14)10(17-2)9(15)6(4)12/h3,7,13-15H,1-2H3/t3-,7+/m0/s1