1-(2,4-dichlorophenyl)-4-methyl-5-[4-(5-nitropentyl)phenyl]-N-piperidin-1-yl-pyrazole-3-carboxamide

Systemtic Name: 1-(2,4-dichlorophenyl)-4-methyl-5-[4-(5-nitropentyl)phenyl]-N-piperidin-1-yl-pyrazole-3-carboxamide Openeye Name: 1-(2,4-dichlorophenyl)-4-methyl-5-[4-(5-nitropentyl)phenyl]-N-(1-piperidyl)pyrazole-3-carboxamide CAS Name: 1-(2,4-dichlorophenyl)-4-methyl-5-[4-(5-nitropentyl)phenyl]-N-(1-piperidinyl)-3-pyrazolecarboxamide IUPAC Name: 1-(2,4-dichlorophenyl)-4-methyl-5-[4-(5-nitropentyl)phenyl]-N-piperidin-1-ylpyrazole-3-carboxamide Traditional Name: 1-(2,4-dichlorophenyl)-4-methyl-5-[4-(5-nitropentyl)phenyl]-N-piperidino-pyrazole-3-carboxamide Formula: C27H31Cl2N5O3 MolecularWeight: 544.47274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=C1C(=O)NN2CCCCC2)C3=C(C=C(C=C3)Cl)Cl)C4=CC=C(C=C4)CCCCC[N+](=O)[O-]

Isomeric SMILES

CC1=C(N(N=C1C(=O)NN2CCCCC2)C3=C(C=C(C=C3)Cl)Cl)C4=CC=C(C=C4)CCCCC[N+](=O)[O-]

InChI

InChI=1S/C27H31Cl2N5O3/c1-19-25(27(35)31-32-15-5-3-6-16-32)30-34(24-14-13-22(28)18-23(24)29)26(19)21-11-9-20(10-12-21)8-4-2-7-17-33(36)37/h9-14,18H,2-8,15-17H2,1H3,(H,31,35)