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

Systemtic Name: N-(5-benzamido-2-phenyl-1,2,4-triazol-3-yl)-3-nitro-benzamide Openeye Name: N-(5-benzamido-2-phenyl-1,2,4-triazol-3-yl)-3-nitro-benzamide CAS Name: N-(5-benzamido-2-phenyl-1,2,4-triazol-3-yl)-3-nitrobenzamide IUPAC Name: N-(5-benzamido-2-phenyl-1,2,4-triazol-3-yl)-3-nitrobenzamide Traditional Name: N-(5-benzamido-2-phenyl-1,2,4-triazol-3-yl)-3-nitro-benzamide Formula: C22H16N6O4 MolecularWeight: 428.40024

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=NN(C(=N2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=NN(C(=N2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C22H16N6O4/c29-19(15-8-3-1-4-9-15)23-21-25-22(27(26-21)17-11-5-2-6-12-17)24-20(30)16-10-7-13-18(14-16)28(31)32/h1-14H,(H2,23,24,25,26,29,30)