2-(3-iodanylprop-2-ynyl)-5-methyl-4-phenyl-1,2,4-triazol-3-one

Systemtic Name: 2-(3-iodanylprop-2-ynyl)-5-methyl-4-phenyl-1,2,4-triazol-3-one Openeye Name: 2-(3-iodoprop-2-ynyl)-5-methyl-4-phenyl-1,2,4-triazol-3-one CAS Name: 2-(3-iodoprop-2-ynyl)-5-methyl-4-phenyl-1,2,4-triazol-3-one IUPAC Name: 2-(3-iodoprop-2-ynyl)-5-methyl-4-phenyl-1,2,4-triazol-3-one Traditional Name: 2-(3-iodoprop-2-ynyl)-5-methyl-4-phenyl-1,2,4-triazol-3-one Formula: C12H10IN3O MolecularWeight: 339.13177

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)N1C2=CC=CC=C2)CC#CI

Isomeric SMILES

CC1=NN(C(=O)N1C2=CC=CC=C2)CC#CI

InChI

InChI=1S/C12H10IN3O/c1-10-14-15(9-5-8-13)12(17)16(10)11-6-3-2-4-7-11/h2-4,6-7H,9H2,1H3