N-[(1-ethylpyrazol-4-yl)methyl]-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-[(1-ethylpyrazol-4-yl)methyl]-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-[(1-ethylpyrazol-4-yl)methyl]-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-[(1-ethyl-4-pyrazolyl)methyl]-1-[(2-nitrophenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[(1-ethylpyrazol-4-yl)methyl]-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-[(1-ethylpyrazol-4-yl)methyl]-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide Formula: C17H18N6O4 MolecularWeight: 370.36262

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)CNC(=O)C2=NN(C=C2)COC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCN1C=C(C=N1)CNC(=O)C2=NN(C=C2)COC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C17H18N6O4/c1-2-21-11-13(10-19-21)9-18-17(24)14-7-8-22(20-14)12-27-16-6-4-3-5-15(16)23(25)26/h3-8,10-11H,2,9,12H2,1H3,(H,18,24)