2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(1-pyridin-4-ylethyl)ethanamide

Systemtic Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(1-pyridin-4-ylethyl)ethanamide Openeye Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[1-(4-pyridyl)ethyl]acetamide CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-N-(1-pyridin-4-ylethyl)acetamide IUPAC Name: 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(1-pyridin-4-ylethyl)acetamide Traditional Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[1-(4-pyridyl)ethyl]acetamide Formula: C14H17N5O3 MolecularWeight: 303.31648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC(C)C2=CC=NC=C2)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC(C)C2=CC=NC=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C14H17N5O3/c1-9(12-4-6-15-7-5-12)16-13(20)8-18-11(3)14(19(21)22)10(2)17-18/h4-7,9H,8H2,1-3H3,(H,16,20)