2,5-dimethyl-4-nitro-N-[(4-pyrazol-1-ylphenyl)methyl]pyrazole-3-carboxamide

Systemtic Name: 2,5-dimethyl-4-nitro-N-[(4-pyrazol-1-ylphenyl)methyl]pyrazole-3-carboxamide Openeye Name: 2,5-dimethyl-4-nitro-N-[(4-pyrazol-1-ylphenyl)methyl]pyrazole-3-carboxamide CAS Name: 2,5-dimethyl-4-nitro-N-[[4-(1-pyrazolyl)phenyl]methyl]-3-pyrazolecarboxamide IUPAC Name: 2,5-dimethyl-4-nitro-N-[(4-pyrazol-1-ylphenyl)methyl]pyrazole-3-carboxamide Traditional Name: 2,5-dimethyl-4-nitro-N-(4-pyrazol-1-ylbenzyl)pyrazole-3-carboxamide Formula: C16H16N6O3 MolecularWeight: 340.33664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1[N+](=O)[O-])C(=O)NCC2=CC=C(C=C2)N3C=CC=N3)C

Isomeric SMILES

CC1=NN(C(=C1[N+](=O)[O-])C(=O)NCC2=CC=C(C=C2)N3C=CC=N3)C

InChI

InChI=1S/C16H16N6O3/c1-11-14(22(24)25)15(20(2)19-11)16(23)17-10-12-4-6-13(7-5-12)21-9-3-8-18-21/h3-9H,10H2,1-2H3,(H,17,23)