2-(5-bromanyl-3-nitro-1,2,4-triazol-1-yl)-N-phenethyl-ethanamide

Systemtic Name: 2-(5-bromanyl-3-nitro-1,2,4-triazol-1-yl)-N-phenethyl-ethanamide Openeye Name: 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-phenethyl-acetamide CAS Name: 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-phenethylacetamide IUPAC Name: 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-phenethylacetamide Traditional Name: 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-phenethyl-acetamide Formula: C12H12BrN5O3 MolecularWeight: 354.15938

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CN2C(=NC(=N2)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CN2C(=NC(=N2)[N+](=O)[O-])Br

InChI

InChI=1S/C12H12BrN5O3/c13-11-15-12(18(20)21)16-17(11)8-10(19)14-7-6-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,14,19)