3-(2-methylpropoxy)propyl-[(2-phenyl-1,2,3-triazol-4-yl)methyl]azanium

Systemtic Name: 3-(2-methylpropoxy)propyl-[(2-phenyl-1,2,3-triazol-4-yl)methyl]azanium Openeye Name: 3-isobutoxypropyl-[(2-phenyltriazol-4-yl)methyl]ammonium CAS Name: 3-(2-methylpropoxy)propyl-[(2-phenyl-4-triazolyl)methyl]ammonium IUPAC Name: 3-(2-methylpropoxy)propyl-[(2-phenyltriazol-4-yl)methyl]azanium Traditional Name: 3-isobutoxypropyl-[(2-phenyltriazol-4-yl)methyl]ammonium Formula: C16H25N4O+ MolecularWeight: 289.3959

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COCCC[NH2+]CC1=NN(N=C1)C2=CC=CC=C2

Isomeric SMILES

CC(C)COCCC[NH2+]CC1=NN(N=C1)C2=CC=CC=C2

InChI

InChI=1S/C16H24N4O/c1-14(2)13-21-10-6-9-17-11-15-12-18-20(19-15)16-7-4-3-5-8-16/h3-5,7-8,12,14,17H,6,9-11,13H2,1-2H3/p+1