N-methyl-1-(4-nitrophenyl)-N-[(4-piperidin-1-ylphenyl)methyl]pyrazole-4-carboxamide

Systemtic Name: N-methyl-1-(4-nitrophenyl)-N-[(4-piperidin-1-ylphenyl)methyl]pyrazole-4-carboxamide Openeye Name: N-methyl-1-(4-nitrophenyl)-N-[[4-(1-piperidyl)phenyl]methyl]pyrazole-4-carboxamide CAS Name: N-methyl-1-(4-nitrophenyl)-N-[[4-(1-piperidinyl)phenyl]methyl]-4-pyrazolecarboxamide IUPAC Name: N-methyl-1-(4-nitrophenyl)-N-[(4-piperidin-1-ylphenyl)methyl]pyrazole-4-carboxamide Traditional Name: N-methyl-1-(4-nitrophenyl)-N-(4-piperidinobenzyl)pyrazole-4-carboxamide Formula: C23H25N5O3 MolecularWeight: 419.4763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)N2CCCCC2)C(=O)C3=CN(N=C3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=C(C=C1)N2CCCCC2)C(=O)C3=CN(N=C3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H25N5O3/c1-25(16-18-5-7-20(8-6-18)26-13-3-2-4-14-26)23(29)19-15-24-27(17-19)21-9-11-22(12-10-21)28(30)31/h5-12,15,17H,2-4,13-14,16H2,1H3