4-(methylamino)-N-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]-3-nitro-benzamide

Systemtic Name: 4-(methylamino)-N-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]-3-nitro-benzamide Openeye Name: 4-(methylamino)-N-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]-3-nitro-benzamide CAS Name: 4-(methylamino)-N-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]-3-nitrobenzamide IUPAC Name: 4-(methylamino)-N-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]-3-nitrobenzamide Traditional Name: 4-(methylamino)-N-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]-3-nitro-benzamide Formula: C17H16N6O3 MolecularWeight: 352.34734

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)C3=NN=CN3C)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)C3=NN=CN3C)[N+](=O)[O-]

InChI

InChI=1S/C17H16N6O3/c1-18-14-7-6-12(9-15(14)23(25)26)17(24)20-13-5-3-4-11(8-13)16-21-19-10-22(16)2/h3-10,18H,1-2H3,(H,20,24)