1-[(4-bromophenyl)methyl]-2-(4-fluorophenyl)-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline

Systemtic Name: 1-[(4-bromophenyl)methyl]-2-(4-fluorophenyl)-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline Openeye Name: 6-benzyloxy-1-[(4-bromophenyl)methyl]-2-(4-fluorophenyl)-3,4-dihydro-1H-isoquinoline CAS Name: 1-[(4-bromophenyl)methyl]-2-(4-fluorophenyl)-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline IUPAC Name: 1-[(4-bromophenyl)methyl]-2-(4-fluorophenyl)-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline Traditional Name: 6-benzoxy-1-(4-bromobenzyl)-2-(4-fluorophenyl)-3,4-dihydro-1H-isoquinoline Formula: C29H25BrFNO MolecularWeight: 502.417303

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C2=C1C=C(C=C2)OCC3=CC=CC=C3)CC4=CC=C(C=C4)Br)C5=CC=C(C=C5)F

Isomeric SMILES

C1CN(C(C2=C1C=C(C=C2)OCC3=CC=CC=C3)CC4=CC=C(C=C4)Br)C5=CC=C(C=C5)F

InChI

InChI=1S/C29H25BrFNO/c30-24-8-6-21(7-9-24)18-29-28-15-14-27(33-20-22-4-2-1-3-5-22)19-23(28)16-17-32(29)26-12-10-25(31)11-13-26/h1-15,19,29H,16-18,20H2