4-imidazol-1-yl-3-nitro-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide

Systemtic Name: 4-imidazol-1-yl-3-nitro-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide Openeye Name: 4-imidazol-1-yl-3-nitro-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide CAS Name: 4-(1-imidazolyl)-3-nitro-N-[2-[4-(1-pyrazolyl)phenyl]ethyl]benzamide IUPAC Name: 4-imidazol-1-yl-3-nitro-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide Traditional Name: 4-imidazol-1-yl-3-nitro-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide Formula: C21H18N6O3 MolecularWeight: 402.40602

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C2=CC=C(C=C2)CCNC(=O)C3=CC(=C(C=C3)N4C=CN=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CN(N=C1)C2=CC=C(C=C2)CCNC(=O)C3=CC(=C(C=C3)N4C=CN=C4)[N+](=O)[O-]

InChI

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