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

Systemtic Name: 2-(4-chloranyl-5-methyl-3-nitro-pyrazol-1-yl)-N-[4-(piperidin-1-ylmethyl)phenyl]ethanamide Openeye Name: 2-(4-chloro-5-methyl-3-nitro-pyrazol-1-yl)-N-[4-(1-piperidylmethyl)phenyl]acetamide CAS Name: 2-(4-chloro-5-methyl-3-nitro-1-pyrazolyl)-N-[4-(1-piperidinylmethyl)phenyl]acetamide IUPAC Name: 2-(4-chloro-5-methyl-3-nitropyrazol-1-yl)-N-[4-(piperidin-1-ylmethyl)phenyl]acetamide Traditional Name: 2-(4-chloro-5-methyl-3-nitro-pyrazol-1-yl)-N-[4-(piperidinomethyl)phenyl]acetamide Formula: C18H22ClN5O3 MolecularWeight: 391.85198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2=CC=C(C=C2)CN3CCCCC3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2=CC=C(C=C2)CN3CCCCC3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H22ClN5O3/c1-13-17(19)18(24(26)27)21-23(13)12-16(25)20-15-7-5-14(6-8-15)11-22-9-3-2-4-10-22/h5-8H,2-4,9-12H2,1H3,(H,20,25)