5-ethyl-4-methyl-1-phenyl-1,2,3-triazole; perchloric acid

Systemtic Name: 5-ethyl-4-methyl-1-phenyl-1,2,3-triazole; perchloric acid Openeye Name: 5-ethyl-4-methyl-1-phenyl-triazole; perchloric acid CAS Name: 5-ethyl-4-methyl-1-phenyltriazole; perchloric acid IUPAC Name: 5-ethyl-4-methyl-1-phenyltriazole; perchloric acid Traditional Name: 5-ethyl-4-methyl-1-phenyl-triazole; perchloric acid Formula: C11H14ClN3O4 MolecularWeight: 287.69956

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=NN1C2=CC=CC=C2)C.OCl(=O)(=O)=O

Isomeric SMILES

CCC1=C(N=NN1C2=CC=CC=C2)C.OCl(=O)(=O)=O

InChI

InChI=1S/C11H13N3.ClHO4/c1-3-11-9(2)12-13-14(11)10-7-5-4-6-8-10;2-1(3,4)5/h4-8H,3H2,1-2H3;(H,2,3,4,5)