3-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]-N-(3-nitrophenyl)propanamide

Systemtic Name: 3-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]-N-(3-nitrophenyl)propanamide Openeye Name: 3-(1-isobutyl-3,5-dimethyl-pyrazol-4-yl)-N-(3-nitrophenyl)propanamide CAS Name: 3-[3,5-dimethyl-1-(2-methylpropyl)-4-pyrazolyl]-N-(3-nitrophenyl)propanamide IUPAC Name: 3-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]-N-(3-nitrophenyl)propanamide Traditional Name: 3-(1-isobutyl-3,5-dimethyl-pyrazol-4-yl)-N-(3-nitrophenyl)propionamide Formula: C18H24N4O3 MolecularWeight: 344.40816

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24N4O3/c1-12(2)11-21-14(4)17(13(3)20-21)8-9-18(23)19-15-6-5-7-16(10-15)22(24)25/h5-7,10,12H,8-9,11H2,1-4H3,(H,19,23)