1-(cyclohexylidenemethyl)-3-methyl-benzotriazol-3-ium iodide

Systemtic Name: 1-(cyclohexylidenemethyl)-3-methyl-benzotriazol-3-ium iodide Openeye Name: 1-(cyclohexylidenemethyl)-3-methyl-benzotriazol-3-ium iodide CAS Name: 1-(cyclohexylidenemethyl)-3-methylbenzotriazol-3-ium iodide IUPAC Name: 1-(cyclohexylidenemethyl)-3-methylbenzotriazol-3-ium iodide Traditional Name: 1-(cyclohexylidenemethyl)-3-methyl-benzotriazol-3-ium iodide Formula: C14H18IN3 MolecularWeight: 355.21729

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=NN(C2=CC=CC=C21)C=C3CCCCC3.[I-]

Isomeric SMILES

C[N+]1=NN(C2=CC=CC=C21)C=C3CCCCC3.[I-]

InChI

InChI=1S/C14H18N3.HI/c1-16-13-9-5-6-10-14(13)17(15-16)11-12-7-3-2-4-8-12;/h5-6,9-11H,2-4,7-8H2,1H3;1H/q+1;/p-1