4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-methyl-N-[(2-piperidin-1-ylphenyl)methyl]benzamide

Systemtic Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-methyl-N-[(2-piperidin-1-ylphenyl)methyl]benzamide Openeye Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-methyl-N-[[2-(1-piperidyl)phenyl]methyl]benzamide CAS Name: 4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-methyl-N-[[2-(1-piperidinyl)phenyl]methyl]benzamide IUPAC Name: 4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-N-methyl-N-[(2-piperidin-1-ylphenyl)methyl]benzamide Traditional Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-methyl-N-(2-piperidinobenzyl)benzamide Formula: C26H31N5O3 MolecularWeight: 461.55604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)N(C)CC3=CC=CC=C3N4CCCCC4)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)N(C)CC3=CC=CC=C3N4CCCCC4)C)[N+](=O)[O-]

InChI

InChI=1S/C26H31N5O3/c1-19-25(31(33)34)20(2)30(27-19)17-21-11-13-22(14-12-21)26(32)28(3)18-23-9-5-6-10-24(23)29-15-7-4-8-16-29/h5-6,9-14H,4,7-8,15-18H2,1-3H3