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(3S)-6,7-dimethoxy-3-[(1R)-8-methoxy-2-methyl-6,7-bis(oxidanyl)-3,4-dihydro-1H-isoquinolin-1-yl]-3H-2-benzofuran-1-one

(3S)-6,7-dimethoxy-3-[(1R)-8-methoxy-2-methyl-6,7-bis(oxidanyl)-3,4-dihydro-1H-isoquinolin-1-yl]-3H-2-benzofuran-1-one

Systemtic Name:(3S)-6,7-dimethoxy-3-[(1R)-8-methoxy-2-methyl-6,7-bis(oxidanyl)-3,4-dihydro-1H-isoquinolin-1-yl]-3H-2-benzofuran-1-one
Openeye Name:(3S)-3-[(1R)-6,7-dihydroxy-8-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]-6,7-dimethoxy-3H-isobenzofuran-1-one
CAS Name:(3S)-3-[(1R)-6,7-dihydroxy-8-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]-6,7-dimethoxy-3H-isobenzofuran-1-one
IUPAC Name:(3S)-3-[(1R)-6,7-dihydroxy-8-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]-6,7-dimethoxy-3H-2-benzofuran-1-one
Traditional Name:(3S)-3-[(1R)-6,7-dihydroxy-8-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]-6,7-dimethoxy-phthalide
Formula: C21H23NO7
MolecularWeight: 401.40982
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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=CC(=C(C(=C2C1C3C4=C(C(=C(C=C4)OC)OC)C(=O)O3)OC)O)O


Isomeric SMILES

CN1CCC2=CC(=C(C(=C2[C@@H]1[C@@H]3C4=C(C(=C(C=C4)OC)OC)C(=O)O3)OC)O)O


InChI

InChI=1S/C21H23NO7/c1-22-8-7-10-9-12(23)17(24)20(28-4)14(10)16(22)18-11-5-6-13(26-2)19(27-3)15(11)21(25)29-18/h5-6,9,16,18,23-24H,7-8H2,1-4H3/t16-,18+/m1/s1


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