3-(3-nitrophenyl)-5-[(4-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-1,2,4-oxadiazole

Systemtic Name: 3-(3-nitrophenyl)-5-[(4-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-1,2,4-oxadiazole Openeye Name: 3-(3-nitrophenyl)-5-[(4-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-1,2,4-oxadiazole CAS Name: 3-(3-nitrophenyl)-5-[(4-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-1,2,4-oxadiazole IUPAC Name: 3-(3-nitrophenyl)-5-[(4-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-1,2,4-oxadiazole Traditional Name: 3-(3-nitrophenyl)-5-[(4-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-1,2,4-oxadiazole Formula: C24H20N4O3 MolecularWeight: 412.4406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=CC=CC=C2CN1CC3=NC(=NO3)C4=CC(=CC=C4)[N+](=O)[O-])C5=CC=CC=C5

Isomeric SMILES

C1C(C2=CC=CC=C2CN1CC3=NC(=NO3)C4=CC(=CC=C4)[N+](=O)[O-])C5=CC=CC=C5

InChI

InChI=1S/C24H20N4O3/c29-28(30)20-11-6-10-18(13-20)24-25-23(31-26-24)16-27-14-19-9-4-5-12-21(19)22(15-27)17-7-2-1-3-8-17/h1-13,22H,14-16H2