3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(furan-2-ylmethyl)propanamide

Systemtic Name: 3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(furan-2-ylmethyl)propanamide Openeye Name: 3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(2-furylmethyl)propanamide CAS Name: 3-(3,5-dimethyl-4-nitro-1-pyrazolyl)-N-(2-furanylmethyl)propanamide IUPAC Name: 3-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(furan-2-ylmethyl)propanamide Traditional Name: 3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(2-furfuryl)propionamide Formula: C13H16N4O4 MolecularWeight: 292.29054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC(=O)NCC2=CC=CO2)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CCC(=O)NCC2=CC=CO2)C)[N+](=O)[O-]

InChI

InChI=1S/C13H16N4O4/c1-9-13(17(19)20)10(2)16(15-9)6-5-12(18)14-8-11-4-3-7-21-11/h3-4,7H,5-6,8H2,1-2H3,(H,14,18)