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

Systemtic Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-piperidin-1-yl-benzamide Openeye Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(1-piperidyl)benzamide CAS Name: 4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-(1-piperidinyl)benzamide IUPAC Name: 4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-N-piperidin-1-ylbenzamide Traditional Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-piperidino-benzamide Formula: C18H23N5O3 MolecularWeight: 357.40692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NN3CCCCC3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NN3CCCCC3)C)[N+](=O)[O-]

InChI

InChI=1S/C18H23N5O3/c1-13-17(23(25)26)14(2)22(19-13)12-15-6-8-16(9-7-15)18(24)20-21-10-4-3-5-11-21/h6-9H,3-5,10-12H2,1-2H3,(H,20,24)