N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-methyl-ethanamide

Systemtic Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-methyl-ethanamide Openeye Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-methyl-acetamide CAS Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-N-methylacetamide IUPAC Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-methylacetamide Traditional Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-methyl-acetamide Formula: C17H20N4O5 MolecularWeight: 360.3645

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)N(C)CC2COC3=CC=CC=C3O2)C)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C17H20N4O5/c1-11-17(21(23)24)12(2)20(18-11)9-16(22)19(3)8-13-10-25-14-6-4-5-7-15(14)26-13/h4-7,13H,8-10H2,1-3H3/t13-/m0/s1