N-[(1,3-diphenylpyrazol-4-yl)methyl]-2-(3-nitropyrazol-1-yl)ethanamide

Systemtic Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-2-(3-nitropyrazol-1-yl)ethanamide Openeye Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-2-(3-nitropyrazol-1-yl)acetamide CAS Name: N-[(1,3-diphenyl-4-pyrazolyl)methyl]-2-(3-nitro-1-pyrazolyl)acetamide IUPAC Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-2-(3-nitropyrazol-1-yl)acetamide Traditional Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-2-(3-nitropyrazol-1-yl)acetamide Formula: C21H18N6O3 MolecularWeight: 402.40602

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2CNC(=O)CN3C=CC(=N3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2CNC(=O)CN3C=CC(=N3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C21H18N6O3/c28-20(15-25-12-11-19(23-25)27(29)30)22-13-17-14-26(18-9-5-2-6-10-18)24-21(17)16-7-3-1-4-8-16/h1-12,14H,13,15H2,(H,22,28)