N-[(1,3-diphenylpyrazol-4-yl)methyl]-3-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-3-nitro-1H-pyrazole-5-carboxamide Openeye Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-3-nitro-1H-pyrazole-5-carboxamide CAS Name: N-[(1,3-diphenyl-4-pyrazolyl)methyl]-3-nitro-1H-pyrazole-5-carboxamide IUPAC Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-3-nitro-1H-pyrazole-5-carboxamide Traditional Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-3-nitro-1H-pyrazole-5-carboxamide Formula: C20H16N6O3 MolecularWeight: 388.37944

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2CNC(=O)C3=CC(=NN3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2CNC(=O)C3=CC(=NN3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C20H16N6O3/c27-20(17-11-18(23-22-17)26(28)29)21-12-15-13-25(16-9-5-2-6-10-16)24-19(15)14-7-3-1-4-8-14/h1-11,13H,12H2,(H,21,27)(H,22,23)