2-[(4-chloranylphenoxy)methyl]-N-[2-(4-nitropyrazol-1-yl)ethyl]pyrazole-3-carboxamide

Systemtic Name: 2-[(4-chloranylphenoxy)methyl]-N-[2-(4-nitropyrazol-1-yl)ethyl]pyrazole-3-carboxamide Openeye Name: 2-[(4-chlorophenoxy)methyl]-N-[2-(4-nitropyrazol-1-yl)ethyl]pyrazole-3-carboxamide CAS Name: 2-[(4-chlorophenoxy)methyl]-N-[2-(4-nitro-1-pyrazolyl)ethyl]-3-pyrazolecarboxamide IUPAC Name: 2-[(4-chlorophenoxy)methyl]-N-[2-(4-nitropyrazol-1-yl)ethyl]pyrazole-3-carboxamide Traditional Name: 2-[(4-chlorophenoxy)methyl]-N-[2-(4-nitropyrazol-1-yl)ethyl]pyrazole-3-carboxamide Formula: C16H15ClN6O4 MolecularWeight: 390.7811

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCN2C(=CC=N2)C(=O)NCCN3C=C(C=N3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1OCN2C(=CC=N2)C(=O)NCCN3C=C(C=N3)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H15ClN6O4/c17-12-1-3-14(4-2-12)27-11-22-15(5-6-19-22)16(24)18-7-8-21-10-13(9-20-21)23(25)26/h1-6,9-10H,7-8,11H2,(H,18,24)