2-(3-bromanyl-2,5-dimethyl-phenyl)-5-butyl-1,2,3,4-tetrazole

Systemtic Name: 2-(3-bromanyl-2,5-dimethyl-phenyl)-5-butyl-1,2,3,4-tetrazole Openeye Name: 2-(3-bromo-2,5-dimethyl-phenyl)-5-butyl-tetrazole CAS Name: 2-(3-bromo-2,5-dimethylphenyl)-5-butyltetrazole IUPAC Name: 2-(3-bromo-2,5-dimethylphenyl)-5-butyltetrazole Traditional Name: 2-(3-bromo-2,5-dimethyl-phenyl)-5-butyl-tetrazole Formula: C13H17BrN4 MolecularWeight: 309.20488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN(N=N1)C2=C(C(=CC(=C2)C)Br)C

Isomeric SMILES

CCCCC1=NN(N=N1)C2=C(C(=CC(=C2)C)Br)C

InChI

InChI=1S/C13H17BrN4/c1-4-5-6-13-15-17-18(16-13)12-8-9(2)7-11(14)10(12)3/h7-8H,4-6H2,1-3H3