5-[(4-bromanyl-2,5-dihexoxy-phenyl)methyl]-2H-1,2,3,4-tetrazole

Systemtic Name: 5-[(4-bromanyl-2,5-dihexoxy-phenyl)methyl]-2H-1,2,3,4-tetrazole Openeye Name: 5-[(4-bromo-2,5-dihexoxy-phenyl)methyl]-2H-tetrazole CAS Name: 5-[(4-bromo-2,5-dihexoxyphenyl)methyl]-2H-tetrazole IUPAC Name: 5-[(4-bromo-2,5-dihexoxyphenyl)methyl]-2H-tetrazole Traditional Name: 5-(4-bromo-2,5-dihexoxy-benzyl)-2H-tetrazole Formula: C20H31BrN4O2 MolecularWeight: 439.38974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC(=C(C=C1CC2=NNN=N2)OCCCCCC)Br

Isomeric SMILES

CCCCCCOC1=CC(=C(C=C1CC2=NNN=N2)OCCCCCC)Br

InChI

InChI=1S/C20H31BrN4O2/c1-3-5-7-9-11-26-18-15-17(21)19(27-12-10-8-6-4-2)13-16(18)14-20-22-24-25-23-20/h13,15H,3-12,14H2,1-2H3,(H,22,23,24,25)