2-(3-methyl-5-nitro-pyrazol-1-yl)-N-[4-(piperidin-1-ylmethyl)phenyl]ethanamide

Systemtic Name: 2-(3-methyl-5-nitro-pyrazol-1-yl)-N-[4-(piperidin-1-ylmethyl)phenyl]ethanamide Openeye Name: 2-(3-methyl-5-nitro-pyrazol-1-yl)-N-[4-(1-piperidylmethyl)phenyl]acetamide CAS Name: 2-(3-methyl-5-nitro-1-pyrazolyl)-N-[4-(1-piperidinylmethyl)phenyl]acetamide IUPAC Name: 2-(3-methyl-5-nitropyrazol-1-yl)-N-[4-(piperidin-1-ylmethyl)phenyl]acetamide Traditional Name: 2-(3-methyl-5-nitro-pyrazol-1-yl)-N-[4-(piperidinomethyl)phenyl]acetamide Formula: C18H23N5O3 MolecularWeight: 357.40692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)[N+](=O)[O-])CC(=O)NC2=CC=C(C=C2)CN3CCCCC3

Isomeric SMILES

CC1=NN(C(=C1)[N+](=O)[O-])CC(=O)NC2=CC=C(C=C2)CN3CCCCC3

InChI

InChI=1S/C18H23N5O3/c1-14-11-18(23(25)26)22(20-14)13-17(24)19-16-7-5-15(6-8-16)12-21-9-3-2-4-10-21/h5-8,11H,2-4,9-10,12-13H2,1H3,(H,19,24)