1-methyl-N-[4-[3-(3-nitropyrazol-1-yl)propanoylamino]phenyl]pyrazole-3-carboxamide

Systemtic Name: 1-methyl-N-[4-[3-(3-nitropyrazol-1-yl)propanoylamino]phenyl]pyrazole-3-carboxamide Openeye Name: 1-methyl-N-[4-[3-(3-nitropyrazol-1-yl)propanoylamino]phenyl]pyrazole-3-carboxamide CAS Name: 1-methyl-N-[4-[[3-(3-nitro-1-pyrazolyl)-1-oxopropyl]amino]phenyl]-3-pyrazolecarboxamide IUPAC Name: 1-methyl-N-[4-[3-(3-nitropyrazol-1-yl)propanoylamino]phenyl]pyrazole-3-carboxamide Traditional Name: 1-methyl-N-[4-[3-(3-nitropyrazol-1-yl)propanoylamino]phenyl]pyrazole-3-carboxamide Formula: C17H17N7O4 MolecularWeight: 383.36138

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)C(=O)NC2=CC=C(C=C2)NC(=O)CCN3C=CC(=N3)[N+](=O)[O-]

Isomeric SMILES

CN1C=CC(=N1)C(=O)NC2=CC=C(C=C2)NC(=O)CCN3C=CC(=N3)[N+](=O)[O-]

InChI

InChI=1S/C17H17N7O4/c1-22-9-6-14(20-22)17(26)19-13-4-2-12(3-5-13)18-16(25)8-11-23-10-7-15(21-23)24(27)28/h2-7,9-10H,8,11H2,1H3,(H,18,25)(H,19,26)