N-(4-bromophenyl)-1-(4-nitrophenyl)-5-piperidin-4-yl-pyrazole-4-carboxamide

Systemtic Name: N-(4-bromophenyl)-1-(4-nitrophenyl)-5-piperidin-4-yl-pyrazole-4-carboxamide Openeye Name: N-(4-bromophenyl)-1-(4-nitrophenyl)-5-(4-piperidyl)pyrazole-4-carboxamide CAS Name: N-(4-bromophenyl)-1-(4-nitrophenyl)-5-(4-piperidinyl)-4-pyrazolecarboxamide IUPAC Name: N-(4-bromophenyl)-1-(4-nitrophenyl)-5-piperidin-4-ylpyrazole-4-carboxamide Traditional Name: N-(4-bromophenyl)-1-(4-nitrophenyl)-5-(4-piperidyl)pyrazole-4-carboxamide Formula: C21H20BrN5O3 MolecularWeight: 470.3192

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2=C(C=NN2C3=CC=C(C=C3)[N+](=O)[O-])C(=O)NC4=CC=C(C=C4)Br

Isomeric SMILES

C1CNCCC1C2=C(C=NN2C3=CC=C(C=C3)[N+](=O)[O-])C(=O)NC4=CC=C(C=C4)Br

InChI

InChI=1S/C21H20BrN5O3/c22-15-1-3-16(4-2-15)25-21(28)19-13-24-26(20(19)14-9-11-23-12-10-14)17-5-7-18(8-6-17)27(29)30/h1-8,13-14,23H,9-12H2,(H,25,28)