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

Systemtic Name: 2-(4-fluorophenyl)-1-[(4-nitrophenyl)methyl]-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline Openeye Name: 6-benzyloxy-2-(4-fluorophenyl)-1-[(4-nitrophenyl)methyl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-(4-fluorophenyl)-1-[(4-nitrophenyl)methyl]-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-(4-fluorophenyl)-1-[(4-nitrophenyl)methyl]-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline Traditional Name: 6-benzoxy-2-(4-fluorophenyl)-1-(4-nitrobenzyl)-3,4-dihydro-1H-isoquinoline Formula: C29H25FN2O3 MolecularWeight: 468.518803

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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)[N+](=O)[O-])C5=CC=C(C=C5)F

Isomeric SMILES

C1CN(C(C2=C1C=C(C=C2)OCC3=CC=CC=C3)CC4=CC=C(C=C4)[N+](=O)[O-])C5=CC=C(C=C5)F

InChI

InChI=1S/C29H25FN2O3/c30-24-8-12-25(13-9-24)31-17-16-23-19-27(35-20-22-4-2-1-3-5-22)14-15-28(23)29(31)18-21-6-10-26(11-7-21)32(33)34/h1-15,19,29H,16-18,20H2