N-[(3-bromophenyl)methyl]-1-butyl-1,2,3,4-tetrazol-5-amine

Systemtic Name: N-[(3-bromophenyl)methyl]-1-butyl-1,2,3,4-tetrazol-5-amine Openeye Name: N-[(3-bromophenyl)methyl]-1-butyl-tetrazol-5-amine CAS Name: N-[(3-bromophenyl)methyl]-1-butyl-5-tetrazolamine IUPAC Name: N-[(3-bromophenyl)methyl]-1-butyltetrazol-5-amine Traditional Name: (3-bromobenzyl)-(1-butyltetrazol-5-yl)amine Formula: C12H16BrN5 MolecularWeight: 310.19294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=N1)NCC2=CC(=CC=C2)Br

Isomeric SMILES

CCCCN1C(=NN=N1)NCC2=CC(=CC=C2)Br

InChI

InChI=1S/C12H16BrN5/c1-2-3-7-18-12(15-16-17-18)14-9-10-5-4-6-11(13)8-10/h4-6,8H,2-3,7,9H2,1H3,(H,14,15,17)