1-(2-bromophenyl)-N-methyl-N-[(3-nitrophenyl)methyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-(2-bromophenyl)-N-methyl-N-[(3-nitrophenyl)methyl]-1,2,3-triazole-4-carboxamide Openeye Name: 1-(2-bromophenyl)-N-methyl-N-[(3-nitrophenyl)methyl]triazole-4-carboxamide CAS Name: 1-(2-bromophenyl)-N-methyl-N-[(3-nitrophenyl)methyl]-4-triazolecarboxamide IUPAC Name: 1-(2-bromophenyl)-N-methyl-N-[(3-nitrophenyl)methyl]triazole-4-carboxamide Traditional Name: 1-(2-bromophenyl)-N-methyl-N-(3-nitrobenzyl)triazole-4-carboxamide Formula: C17H14BrN5O3 MolecularWeight: 416.22876

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC=C1)[N+](=O)[O-])C(=O)C2=CN(N=N2)C3=CC=CC=C3Br

Isomeric SMILES

CN(CC1=CC(=CC=C1)[N+](=O)[O-])C(=O)C2=CN(N=N2)C3=CC=CC=C3Br

InChI

InChI=1S/C17H14BrN5O3/c1-21(10-12-5-4-6-13(9-12)23(25)26)17(24)15-11-22(20-19-15)16-8-3-2-7-14(16)18/h2-9,11H,10H2,1H3