3-(3-methoxyphenyl)-N-[2-(4-nitropyrazol-1-yl)ethyl]-1H-pyrazole-5-carboxamide

Systemtic Name: 3-(3-methoxyphenyl)-N-[2-(4-nitropyrazol-1-yl)ethyl]-1H-pyrazole-5-carboxamide Openeye Name: 3-(3-methoxyphenyl)-N-[2-(4-nitropyrazol-1-yl)ethyl]-1H-pyrazole-5-carboxamide CAS Name: 3-(3-methoxyphenyl)-N-[2-(4-nitro-1-pyrazolyl)ethyl]-1H-pyrazole-5-carboxamide IUPAC Name: 3-(3-methoxyphenyl)-N-[2-(4-nitropyrazol-1-yl)ethyl]-1H-pyrazole-5-carboxamide Traditional Name: 3-(3-methoxyphenyl)-N-[2-(4-nitropyrazol-1-yl)ethyl]-1H-pyrazole-5-carboxamide Formula: C16H16N6O4 MolecularWeight: 356.33604

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NNC(=C2)C(=O)NCCN3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)C2=NNC(=C2)C(=O)NCCN3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C16H16N6O4/c1-26-13-4-2-3-11(7-13)14-8-15(20-19-14)16(23)17-5-6-21-10-12(9-18-21)22(24)25/h2-4,7-10H,5-6H2,1H3,(H,17,23)(H,19,20)