N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(6-methyl-2-nitro-pyridin-3-yl)oxy-ethanamide

Systemtic Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(6-methyl-2-nitro-pyridin-3-yl)oxy-ethanamide Openeye Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-[(6-methyl-2-nitro-3-pyridyl)oxy]acetamide CAS Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-[(6-methyl-2-nitro-3-pyridinyl)oxy]acetamide IUPAC Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(6-methyl-2-nitropyridin-3-yl)oxyacetamide Traditional Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-[(6-methyl-2-nitro-3-pyridyl)oxy]acetamide Formula: C17H17N3O6 MolecularWeight: 359.33338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)OCC(=O)NCC2COC3=CC=CC=C3O2)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=C(C=C1)OCC(=O)NC[C@H]2COC3=CC=CC=C3O2)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O6/c1-11-6-7-15(17(19-11)20(22)23)25-10-16(21)18-8-12-9-24-13-4-2-3-5-14(13)26-12/h2-7,12H,8-10H2,1H3,(H,18,21)/t12-/m0/s1