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

Systemtic Name: 4-bromanyl-3-nitro-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide Openeye Name: 4-bromo-3-nitro-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide CAS Name: 4-bromo-3-nitro-N-[2-[4-(1-pyrazolyl)phenyl]ethyl]benzamide IUPAC Name: 4-bromo-3-nitro-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide Traditional Name: 4-bromo-3-nitro-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide Formula: C18H15BrN4O3 MolecularWeight: 415.2407

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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)Br)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C18H15BrN4O3/c19-16-7-4-14(12-17(16)23(25)26)18(24)20-10-8-13-2-5-15(6-3-13)22-11-1-9-21-22/h1-7,9,11-12H,8,10H2,(H,20,24)