1-(3-nitrophenyl)-N-[[2-(1,2,4-triazol-1-yl)pyridin-3-yl]methyl]pyrazole-3-carboxamide

Systemtic Name: 1-(3-nitrophenyl)-N-[[2-(1,2,4-triazol-1-yl)pyridin-3-yl]methyl]pyrazole-3-carboxamide Openeye Name: 1-(3-nitrophenyl)-N-[[2-(1,2,4-triazol-1-yl)-3-pyridyl]methyl]pyrazole-3-carboxamide CAS Name: 1-(3-nitrophenyl)-N-[[2-(1,2,4-triazol-1-yl)-3-pyridinyl]methyl]-3-pyrazolecarboxamide IUPAC Name: 1-(3-nitrophenyl)-N-[[2-(1,2,4-triazol-1-yl)pyridin-3-yl]methyl]pyrazole-3-carboxamide Traditional Name: 1-(3-nitrophenyl)-N-[[2-(1,2,4-triazol-1-yl)-3-pyridyl]methyl]pyrazole-3-carboxamide Formula: C18H14N8O3 MolecularWeight: 390.35556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])N2C=CC(=N2)C(=O)NCC3=C(N=CC=C3)N4C=NC=N4

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])N2C=CC(=N2)C(=O)NCC3=C(N=CC=C3)N4C=NC=N4

InChI

InChI=1S/C18H14N8O3/c27-18(21-10-13-3-2-7-20-17(13)25-12-19-11-22-25)16-6-8-24(23-16)14-4-1-5-15(9-14)26(28)29/h1-9,11-12H,10H2,(H,21,27)