2-[6,7-dimethoxy-1-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-isoquinolin-2-yl]-N'-oxidanyl-ethanimidamide

Systemtic Name: 2-[6,7-dimethoxy-1-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-isoquinolin-2-yl]-N'-oxidanyl-ethanimidamide Openeye Name: 2-[6,7-dimethoxy-1-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-isoquinolin-2-yl]-N'-hydroxy-acetamidine CAS Name: 2-[6,7-dimethoxy-1-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-isoquinolin-2-yl]-N'-hydroxyethanimidamide IUPAC Name: 2-[6,7-dimethoxy-1-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-isoquinolin-2-yl]-N'-hydroxyethanimidamide Traditional Name: 2-[6,7-dimethoxy-1-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-isoquinolin-2-yl]-N'-hydroxy-acetamidine Formula: C22H29N3O6 MolecularWeight: 431.48216

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2C3=CC(=C(C=C3CCN2CC(=NO)N)OC)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2C3=CC(=C(C=C3CCN2C/C(=N/O)/N)OC)OC

InChI

InChI=1S/C22H29N3O6/c1-27-16-8-13-6-7-25(12-20(23)24-26)21(15(13)11-17(16)28-2)14-9-18(29-3)22(31-5)19(10-14)30-4/h8-11,21,26H,6-7,12H2,1-5H3,(H2,23,24)