1-[(1S)-1-(5-bromanyl-2-oxidanyl-phenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethanone

Systemtic Name: 1-[(1S)-1-(5-bromanyl-2-oxidanyl-phenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Openeye Name: 1-[(1S)-1-(5-bromo-2-hydroxy-phenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethanone CAS Name: 1-[(1S)-1-(5-bromo-2-hydroxyphenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethanone IUPAC Name: 1-[(1S)-1-(5-bromo-2-hydroxyphenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Traditional Name: 1-[(1S)-1-(5-bromo-2-hydroxy-phenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Formula: C19H20BrNO4 MolecularWeight: 406.2704

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=CC(=C(C=C2C1C3=C(C=CC(=C3)Br)O)OC)OC

Isomeric SMILES

CC(=O)N1CCC2=CC(=C(C=C2[C@H]1C3=C(C=CC(=C3)Br)O)OC)OC

InChI

InChI=1S/C19H20BrNO4/c1-11(22)21-7-6-12-8-17(24-2)18(25-3)10-14(12)19(21)15-9-13(20)4-5-16(15)23/h4-5,8-10,19,23H,6-7H2,1-3H3/t19-/m0/s1