N-(3-ethanoylphenyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide

Systemtic Name: N-(3-ethanoylphenyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-(3-acetylphenyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-(3-acetylphenyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-(3-acetylphenyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-(3-acetylphenyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Formula: C17H13N5O4 MolecularWeight: 351.31622

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

InChI

InChI=1S/C17H13N5O4/c1-11(23)12-3-2-4-14(7-12)20-17(24)13-5-6-15(16(8-13)22(25)26)21-10-18-9-19-21/h2-10H,1H3,(H,20,24)