N-(4-methylphenyl)-2-(3-nitro-1,2,4-triazol-1-yl)ethanamide

Systemtic Name: N-(4-methylphenyl)-2-(3-nitro-1,2,4-triazol-1-yl)ethanamide Openeye Name: 2-(3-nitro-1,2,4-triazol-1-yl)-N-(p-tolyl)acetamide CAS Name: N-(4-methylphenyl)-2-(3-nitro-1,2,4-triazol-1-yl)acetamide IUPAC Name: N-(4-methylphenyl)-2-(3-nitro-1,2,4-triazol-1-yl)acetamide Traditional Name: 2-(3-nitro-1,2,4-triazol-1-yl)-N-(p-tolyl)acetamide Formula: C11H11N5O3 MolecularWeight: 261.23674

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11N5O3/c1-8-2-4-9(5-3-8)13-10(17)6-15-7-12-11(14-15)16(18)19/h2-5,7H,6H2,1H3,(H,13,17)