2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-N-(oxolan-2-ylmethyl)propanamide

Systemtic Name: 2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-N-(oxolan-2-ylmethyl)propanamide Openeye Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-(tetrahydrofuran-2-ylmethyl)propanamide CAS Name: 2-(4-bromo-5-methyl-3-nitro-1-pyrazolyl)-N-(2-oxolanylmethyl)propanamide IUPAC Name: 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-(oxolan-2-ylmethyl)propanamide Traditional Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-(tetrahydrofurfuryl)propionamide Formula: C12H17BrN4O4 MolecularWeight: 361.19178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(C)C(=O)NCC2CCCO2)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C(=NN1C(C)C(=O)NCC2CCCO2)[N+](=O)[O-])Br

InChI

InChI=1S/C12H17BrN4O4/c1-7-10(13)11(17(19)20)15-16(7)8(2)12(18)14-6-9-4-3-5-21-9/h8-9H,3-6H2,1-2H3,(H,14,18)