1-[1-(2-chloranyl-6-fluoranyl-phenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-2-phenylmethoxy-ethanone

Systemtic Name: 1-[1-(2-chloranyl-6-fluoranyl-phenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-2-phenylmethoxy-ethanone Openeye Name: 2-benzyloxy-1-[1-(2-chloro-6-fluoro-phenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethanone CAS Name: 1-[1-(2-chloro-6-fluorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-2-phenylmethoxyethanone IUPAC Name: 1-[1-(2-chloro-6-fluorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-2-phenylmethoxyethanone Traditional Name: 2-benzoxy-1-[1-(2-chloro-6-fluoro-phenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Formula: C26H25ClFNO4 MolecularWeight: 469.932403

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)COCC3=CC=CC=C3)C4=C(C=CC=C4Cl)F)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)C(=O)COCC3=CC=CC=C3)C4=C(C=CC=C4Cl)F)OC

InChI

InChI=1S/C26H25ClFNO4/c1-31-22-13-18-11-12-29(24(30)16-33-15-17-7-4-3-5-8-17)26(19(18)14-23(22)32-2)25-20(27)9-6-10-21(25)28/h3-10,13-14,26H,11-12,15-16H2,1-2H3