2-(4-methylpiperidin-1-yl)-N-(1-methylpyrazol-3-yl)-5-nitro-benzamide

Systemtic Name: 2-(4-methylpiperidin-1-yl)-N-(1-methylpyrazol-3-yl)-5-nitro-benzamide Openeye Name: 2-(4-methyl-1-piperidyl)-N-(1-methylpyrazol-3-yl)-5-nitro-benzamide CAS Name: 2-(4-methyl-1-piperidinyl)-N-(1-methyl-3-pyrazolyl)-5-nitrobenzamide IUPAC Name: 2-(4-methylpiperidin-1-yl)-N-(1-methylpyrazol-3-yl)-5-nitrobenzamide Traditional Name: 2-(4-methylpiperidino)-N-(1-methylpyrazol-3-yl)-5-nitro-benzamide Formula: C17H21N5O3 MolecularWeight: 343.38034

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=NN(C=C3)C

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=NN(C=C3)C

InChI

InChI=1S/C17H21N5O3/c1-12-5-9-21(10-6-12)15-4-3-13(22(24)25)11-14(15)17(23)18-16-7-8-20(2)19-16/h3-4,7-8,11-12H,5-6,9-10H2,1-2H3,(H,18,19,23)