N-(4-bromanyl-3-methyl-phenyl)-2-(3-nitro-1,2,4-triazol-1-yl)ethanamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-2-(3-nitro-1,2,4-triazol-1-yl)ethanamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-2-(3-nitro-1,2,4-triazol-1-yl)acetamide CAS Name: N-(4-bromo-3-methylphenyl)-2-(3-nitro-1,2,4-triazol-1-yl)acetamide IUPAC Name: N-(4-bromo-3-methylphenyl)-2-(3-nitro-1,2,4-triazol-1-yl)acetamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-2-(3-nitro-1,2,4-triazol-1-yl)acetamide Formula: C11H10BrN5O3 MolecularWeight: 340.1328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CN2C=NC(=N2)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CN2C=NC(=N2)[N+](=O)[O-])Br

InChI

InChI=1S/C11H10BrN5O3/c1-7-4-8(2-3-9(7)12)14-10(18)5-16-6-13-11(15-16)17(19)20/h2-4,6H,5H2,1H3,(H,14,18)