N-[4-[2-(5-bromanyl-3-nitro-1,2,4-triazol-1-yl)ethanoyl]phenyl]ethanamide

Systemtic Name: N-[4-[2-(5-bromanyl-3-nitro-1,2,4-triazol-1-yl)ethanoyl]phenyl]ethanamide Openeye Name: N-[4-[2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)acetyl]phenyl]acetamide CAS Name: N-[4-[2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-1-oxoethyl]phenyl]acetamide IUPAC Name: N-[4-[2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)acetyl]phenyl]acetamide Traditional Name: N-[4-[2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)acetyl]phenyl]acetamide Formula: C12H10BrN5O4 MolecularWeight: 368.1429

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(=O)CN2C(=NC(=N2)[N+](=O)[O-])Br

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C(=O)CN2C(=NC(=N2)[N+](=O)[O-])Br

InChI

InChI=1S/C12H10BrN5O4/c1-7(19)14-9-4-2-8(3-5-9)10(20)6-17-11(13)15-12(16-17)18(21)22/h2-5H,6H2,1H3,(H,14,19)