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

Systemtic Name: 2-(4-chloranyl-5-methyl-3-nitro-pyrazol-1-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]ethanamide Openeye Name: 2-(4-chloro-5-methyl-3-nitro-pyrazol-1-yl)-N-[3-(morpholinomethyl)phenyl]acetamide CAS Name: 2-(4-chloro-5-methyl-3-nitro-1-pyrazolyl)-N-[3-(4-morpholinylmethyl)phenyl]acetamide IUPAC Name: 2-(4-chloro-5-methyl-3-nitropyrazol-1-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]acetamide Traditional Name: 2-(4-chloro-5-methyl-3-nitro-pyrazol-1-yl)-N-[3-(morpholinomethyl)phenyl]acetamide Formula: C17H20ClN5O4 MolecularWeight: 393.8248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2=CC=CC(=C2)CN3CCOCC3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2=CC=CC(=C2)CN3CCOCC3)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H20ClN5O4/c1-12-16(18)17(23(25)26)20-22(12)11-15(24)19-14-4-2-3-13(9-14)10-21-5-7-27-8-6-21/h2-4,9H,5-8,10-11H2,1H3,(H,19,24)