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

Systemtic Name: 4-(2-azidoethyl)-5-methyl-2-phenyl-1,2,4-triazol-3-one Openeye Name: 4-(2-azidoethyl)-5-methyl-2-phenyl-1,2,4-triazol-3-one CAS Name: 4-(2-azidoethyl)-5-methyl-2-phenyl-1,2,4-triazol-3-one IUPAC Name: 4-(2-azidoethyl)-5-methyl-2-phenyl-1,2,4-triazol-3-one Traditional Name: 4-(2-azidoethyl)-5-methyl-2-phenyl-1,2,4-triazol-3-one Formula: C11H12N6O MolecularWeight: 244.25258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)N1CCN=[N+]=[N-])C2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=O)N1CCN=[N+]=[N-])C2=CC=CC=C2

InChI

InChI=1S/C11H12N6O/c1-9-14-17(10-5-3-2-4-6-10)11(18)16(9)8-7-13-15-12/h2-6H,7-8H2,1H3