[(2S)-6-methylheptan-2-yl]-[(2-phenyl-1,2,3-triazol-4-yl)methyl]azanium

Systemtic Name: [(2S)-6-methylheptan-2-yl]-[(2-phenyl-1,2,3-triazol-4-yl)methyl]azanium Openeye Name: [(1S)-1,5-dimethylhexyl]-[(2-phenyltriazol-4-yl)methyl]ammonium CAS Name: [(2S)-6-methylheptan-2-yl]-[(2-phenyl-4-triazolyl)methyl]ammonium IUPAC Name: [(2S)-6-methylheptan-2-yl]-[(2-phenyltriazol-4-yl)methyl]azanium Traditional Name: [(1S)-1,5-dimethylhexyl]-[(2-phenyltriazol-4-yl)methyl]ammonium Formula: C17H27N4+ MolecularWeight: 287.42308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](CCCC(C)C)[NH2+]CC1=NN(N=C1)C2=CC=CC=C2

InChI

InChI=1S/C17H26N4/c1-14(2)8-7-9-15(3)18-12-16-13-19-21(20-16)17-10-5-4-6-11-17/h4-6,10-11,13-15,18H,7-9,12H2,1-3H3/p+1/t15-/m0/s1