5-[[1-bromanyl-6-(3-pentyl-1-benzofuran-2-yl)naphthalen-2-yl]oxymethyl]-2H-1,2,3,4-tetrazole

Systemtic Name: 5-[[1-bromanyl-6-(3-pentyl-1-benzofuran-2-yl)naphthalen-2-yl]oxymethyl]-2H-1,2,3,4-tetrazole Openeye Name: 5-[[1-bromo-6-(3-pentylbenzofuran-2-yl)-2-naphthyl]oxymethyl]-2H-tetrazole CAS Name: 5-[[1-bromo-6-(3-pentyl-2-benzofuranyl)-2-naphthalenyl]oxymethyl]-2H-tetrazole IUPAC Name: 5-[[1-bromo-6-(3-pentyl-1-benzofuran-2-yl)naphthalen-2-yl]oxymethyl]-2H-tetrazole Traditional Name: 5-[[6-(3-amylbenzofuran-2-yl)-1-bromo-2-naphthoxy]methyl]-2H-tetrazole Formula: C25H23BrN4O2 MolecularWeight: 491.37972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(OC2=CC=CC=C21)C3=CC4=C(C=C3)C(=C(C=C4)OCC5=NNN=N5)Br

Isomeric SMILES

CCCCCC1=C(OC2=CC=CC=C21)C3=CC4=C(C=C3)C(=C(C=C4)OCC5=NNN=N5)Br

InChI

InChI=1S/C25H23BrN4O2/c1-2-3-4-8-20-19-7-5-6-9-21(19)32-25(20)17-10-12-18-16(14-17)11-13-22(24(18)26)31-15-23-27-29-30-28-23/h5-7,9-14H,2-4,8,15H2,1H3,(H,27,28,29,30)