N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)ethanamide

Systemtic Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)ethanamide Openeye Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)acetamide CAS Name: N-[2-[(4-bromophenyl)methyl]-3-pyrazolyl]-2-(4-nitro-1-pyrazolyl)acetamide IUPAC Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)acetamide Traditional Name: N-[2-(4-bromobenzyl)pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)acetamide Formula: C15H13BrN6O3 MolecularWeight: 405.20612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C(=CC=N2)NC(=O)CN3C=C(C=N3)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=CC=C1CN2C(=CC=N2)NC(=O)CN3C=C(C=N3)[N+](=O)[O-])Br

InChI

InChI=1S/C15H13BrN6O3/c16-12-3-1-11(2-4-12)8-21-14(5-6-17-21)19-15(23)10-20-9-13(7-18-20)22(24)25/h1-7,9H,8,10H2,(H,19,23)