N-[(2-phenyl-1,2,3-triazol-4-yl)methyl]hexan-1-amine

Systemtic Name: N-[(2-phenyl-1,2,3-triazol-4-yl)methyl]hexan-1-amine Openeye Name: N-[(2-phenyltriazol-4-yl)methyl]hexan-1-amine CAS Name: N-[(2-phenyl-4-triazolyl)methyl]-1-hexanamine IUPAC Name: N-[(2-phenyltriazol-4-yl)methyl]hexan-1-amine Traditional Name: hexyl-[(2-phenyltriazol-4-yl)methyl]amine Formula: C15H22N4 MolecularWeight: 258.36198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNCC1=NN(N=C1)C2=CC=CC=C2

Isomeric SMILES

CCCCCCNCC1=NN(N=C1)C2=CC=CC=C2

InChI

InChI=1S/C15H22N4/c1-2-3-4-8-11-16-12-14-13-17-19(18-14)15-9-6-5-7-10-15/h5-7,9-10,13,16H,2-4,8,11-12H2,1H3