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N-[(3-chlorophenyl)methyl]-1-(4-nitrophenyl)-5-piperidin-4-yl-pyrazole-4-carboxamide

N-[(3-chlorophenyl)methyl]-1-(4-nitrophenyl)-5-piperidin-4-yl-pyrazole-4-carboxamide

Systemtic Name:N-[(3-chlorophenyl)methyl]-1-(4-nitrophenyl)-5-piperidin-4-yl-pyrazole-4-carboxamide
Openeye Name:N-[(3-chlorophenyl)methyl]-1-(4-nitrophenyl)-5-(4-piperidyl)pyrazole-4-carboxamide
CAS Name:N-[(3-chlorophenyl)methyl]-1-(4-nitrophenyl)-5-(4-piperidinyl)-4-pyrazolecarboxamide
IUPAC Name:N-[(3-chlorophenyl)methyl]-1-(4-nitrophenyl)-5-piperidin-4-ylpyrazole-4-carboxamide
Traditional Name:N-(3-chlorobenzyl)-1-(4-nitrophenyl)-5-(4-piperidyl)pyrazole-4-carboxamide
Formula: C22H22ClN5O3
MolecularWeight: 439.89478
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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2=C(C=NN2C3=CC=C(C=C3)[N+](=O)[O-])C(=O)NCC4=CC(=CC=C4)Cl


Isomeric SMILES

C1CNCCC1C2=C(C=NN2C3=CC=C(C=C3)[N+](=O)[O-])C(=O)NCC4=CC(=CC=C4)Cl


InChI

InChI=1S/C22H22ClN5O3/c23-17-3-1-2-15(12-17)13-25-22(29)20-14-26-27(21(20)16-8-10-24-11-9-16)18-4-6-19(7-5-18)28(30)31/h1-7,12,14,16,24H,8-11,13H2,(H,25,29)


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