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

Systemtic Name: N-[(5-bromanyl-2-phenylmethoxy-phenyl)methyl]-1-butyl-1,2,3,4-tetrazol-5-amine Openeye Name: N-[(2-benzyloxy-5-bromo-phenyl)methyl]-1-butyl-tetrazol-5-amine CAS Name: N-[(5-bromo-2-phenylmethoxyphenyl)methyl]-1-butyl-5-tetrazolamine IUPAC Name: N-[(5-bromo-2-phenylmethoxyphenyl)methyl]-1-butyltetrazol-5-amine Traditional Name: (2-benzoxy-5-bromo-benzyl)-(1-butyltetrazol-5-yl)amine Formula: C19H22BrN5O MolecularWeight: 416.31488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=N1)NCC2=C(C=CC(=C2)Br)OCC3=CC=CC=C3

Isomeric SMILES

CCCCN1C(=NN=N1)NCC2=C(C=CC(=C2)Br)OCC3=CC=CC=C3

InChI

InChI=1S/C19H22BrN5O/c1-2-3-11-25-19(22-23-24-25)21-13-16-12-17(20)9-10-18(16)26-14-15-7-5-4-6-8-15/h4-10,12H,2-3,11,13-14H2,1H3,(H,21,22,24)