[1-[1,3-bis(oxidanyl)propan-2-yl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-phenyl-methanone

Systemtic Name: [1-[1,3-bis(oxidanyl)propan-2-yl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-phenyl-methanone Openeye Name: [1-[2-hydroxy-1-(hydroxymethyl)ethyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-phenyl-methanone CAS Name: [1-(1,3-dihydroxypropan-2-yl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-phenylmethanone IUPAC Name: [1-(1,3-dihydroxypropan-2-yl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-phenylmethanone Traditional Name: [1-(2-hydroxy-1-methylol-ethyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-phenyl-methanone Formula: C21H25NO5 MolecularWeight: 371.4269

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)C3=CC=CC=C3)C(CO)CO)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)C(=O)C3=CC=CC=C3)C(CO)CO)OC

InChI

InChI=1S/C21H25NO5/c1-26-18-10-15-8-9-22(21(25)14-6-4-3-5-7-14)20(16(12-23)13-24)17(15)11-19(18)27-2/h3-7,10-11,16,20,23-24H,8-9,12-13H2,1-2H3