(5-bromanyl-2-oxidanyl-phenyl)-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone

Systemtic Name: (5-bromanyl-2-oxidanyl-phenyl)-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: (5-bromo-2-hydroxy-phenyl)-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: (5-bromo-2-hydroxyphenyl)-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: (5-bromo-2-hydroxyphenyl)-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: (5-bromo-2-hydroxy-phenyl)-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C20H22BrNO4 MolecularWeight: 420.29698

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2CN(CCC2=C1)C(=O)C3=C(C=CC(=C3)Br)O)OCC

Isomeric SMILES

CCOC1=C(C=C2CN(CCC2=C1)C(=O)C3=C(C=CC(=C3)Br)O)OCC

InChI

InChI=1S/C20H22BrNO4/c1-3-25-18-9-13-7-8-22(12-14(13)10-19(18)26-4-2)20(24)16-11-15(21)5-6-17(16)23/h5-6,9-11,23H,3-4,7-8,12H2,1-2H3