(3R)-N-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: (3R)-N-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: (3R)-N-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: (3R)-N-[2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-oxoethyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: (3R)-N-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: (3R)-N-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C16H16N4O6 MolecularWeight: 360.32144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC(=O)C2COC3=CC=CC=C3O2)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC(=O)[C@H]2COC3=CC=CC=C3O2)C)[N+](=O)[O-]

InChI

InChI=1S/C16H16N4O6/c1-9-15(20(23)24)10(2)19(18-9)7-14(21)17-16(22)13-8-25-11-5-3-4-6-12(11)26-13/h3-6,13H,7-8H2,1-2H3,(H,17,21,22)/t13-/m1/s1