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

Systemtic Name: 4-(2-azidoethyl)-2-(4-bromophenyl)-5-methyl-1,2,4-triazol-3-one Openeye Name: 4-(2-azidoethyl)-2-(4-bromophenyl)-5-methyl-1,2,4-triazol-3-one CAS Name: 4-(2-azidoethyl)-2-(4-bromophenyl)-5-methyl-1,2,4-triazol-3-one IUPAC Name: 4-(2-azidoethyl)-2-(4-bromophenyl)-5-methyl-1,2,4-triazol-3-one Traditional Name: 4-(2-azidoethyl)-2-(4-bromophenyl)-5-methyl-1,2,4-triazol-3-one Formula: C11H11BrN6O MolecularWeight: 323.14864

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11BrN6O/c1-8-15-18(10-4-2-9(12)3-5-10)11(19)17(8)7-6-14-16-13/h2-5H,6-7H2,1H3