4-methyl-3-nitro-N-(5-phenyl-1H-1,2,4-triazol-3-yl)benzamide

Systemtic Name: 4-methyl-3-nitro-N-(5-phenyl-1H-1,2,4-triazol-3-yl)benzamide Openeye Name: 4-methyl-3-nitro-N-(5-phenyl-1H-1,2,4-triazol-3-yl)benzamide CAS Name: 4-methyl-3-nitro-N-(5-phenyl-1H-1,2,4-triazol-3-yl)benzamide IUPAC Name: 4-methyl-3-nitro-N-(5-phenyl-1H-1,2,4-triazol-3-yl)benzamide Traditional Name: 4-methyl-3-nitro-N-(5-phenyl-1H-1,2,4-triazol-3-yl)benzamide Formula: C16H13N5O3 MolecularWeight: 323.30612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=NNC(=N2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=NNC(=N2)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N5O3/c1-10-7-8-12(9-13(10)21(23)24)15(22)18-16-17-14(19-20-16)11-5-3-2-4-6-11/h2-9H,1H3,(H2,17,18,19,20,22)