N-(2,4-dichlorophenyl)-1-(4-nitrophenyl)-5-piperidin-4-yl-pyrazole-4-carboxamide

Systemtic Name: N-(2,4-dichlorophenyl)-1-(4-nitrophenyl)-5-piperidin-4-yl-pyrazole-4-carboxamide Openeye Name: N-(2,4-dichlorophenyl)-1-(4-nitrophenyl)-5-(4-piperidyl)pyrazole-4-carboxamide CAS Name: N-(2,4-dichlorophenyl)-1-(4-nitrophenyl)-5-(4-piperidinyl)-4-pyrazolecarboxamide IUPAC Name: N-(2,4-dichlorophenyl)-1-(4-nitrophenyl)-5-piperidin-4-ylpyrazole-4-carboxamide Traditional Name: N-(2,4-dichlorophenyl)-1-(4-nitrophenyl)-5-(4-piperidyl)pyrazole-4-carboxamide Formula: C21H19Cl2N5O3 MolecularWeight: 460.31326

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19Cl2N5O3/c22-14-1-6-19(18(23)11-14)26-21(29)17-12-25-27(20(17)13-7-9-24-10-8-13)15-2-4-16(5-3-15)28(30)31/h1-6,11-13,24H,7-10H2,(H,26,29)