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

Systemtic Name: N-[(2-phenyl-1,2,3-triazol-4-yl)methyl]heptan-2-amine Openeye Name: N-[(2-phenyltriazol-4-yl)methyl]heptan-2-amine CAS Name: N-[(2-phenyl-4-triazolyl)methyl]-2-heptanamine IUPAC Name: N-[(2-phenyltriazol-4-yl)methyl]heptan-2-amine Traditional Name: 1-methylhexyl-[(2-phenyltriazol-4-yl)methyl]amine Formula: C16H24N4 MolecularWeight: 272.38856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NCC1=NN(N=C1)C2=CC=CC=C2

Isomeric SMILES

CCCCCC(C)NCC1=NN(N=C1)C2=CC=CC=C2

InChI

InChI=1S/C16H24N4/c1-3-4-6-9-14(2)17-12-15-13-18-20(19-15)16-10-7-5-8-11-16/h5,7-8,10-11,13-14,17H,3-4,6,9,12H2,1-2H3