N-[[2-(benzotriazol-1-yl)-4-bromanyl-phenyl]methyl]propan-1-amine

Systemtic Name: N-[[2-(benzotriazol-1-yl)-4-bromanyl-phenyl]methyl]propan-1-amine Openeye Name: N-[[2-(benzotriazol-1-yl)-4-bromo-phenyl]methyl]propan-1-amine CAS Name: N-[[2-(1-benzotriazolyl)-4-bromophenyl]methyl]-1-propanamine IUPAC Name: N-[[2-(benzotriazol-1-yl)-4-bromophenyl]methyl]propan-1-amine Traditional Name: [2-(benzotriazol-1-yl)-4-bromo-benzyl]-propyl-amine Formula: C16H17BrN4 MolecularWeight: 345.23698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNCC1=C(C=C(C=C1)Br)N2C3=CC=CC=C3N=N2

Isomeric SMILES

CCCNCC1=C(C=C(C=C1)Br)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C16H17BrN4/c1-2-9-18-11-12-7-8-13(17)10-16(12)21-15-6-4-3-5-14(15)19-20-21/h3-8,10,18H,2,9,11H2,1H3