[2-[3-(dimethylaminomethyl)-1,2,4-triazol-4-yl]-5-nitro-phenyl]-pyridin-2-yl-methanone

Systemtic Name: [2-[3-(dimethylaminomethyl)-1,2,4-triazol-4-yl]-5-nitro-phenyl]-pyridin-2-yl-methanone Openeye Name: [2-[3-(dimethylaminomethyl)-1,2,4-triazol-4-yl]-5-nitro-phenyl]-(2-pyridyl)methanone CAS Name: [2-[3-(dimethylaminomethyl)-1,2,4-triazol-4-yl]-5-nitrophenyl]-(2-pyridinyl)methanone IUPAC Name: [2-[3-(dimethylaminomethyl)-1,2,4-triazol-4-yl]-5-nitrophenyl]-pyridin-2-ylmethanone Traditional Name: [2-[3-(dimethylaminomethyl)-1,2,4-triazol-4-yl]-5-nitro-phenyl]-(2-pyridyl)methanone Formula: C17H16N6O3 MolecularWeight: 352.34734

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=NN=CN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=N3

Isomeric SMILES

CN(C)CC1=NN=CN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=N3

InChI

InChI=1S/C17H16N6O3/c1-21(2)10-16-20-19-11-22(16)15-7-6-12(23(25)26)9-13(15)17(24)14-5-3-4-8-18-14/h3-9,11H,10H2,1-2H3