N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(2-nitrophenoxy)ethanamide

Systemtic Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(2-nitrophenoxy)ethanamide Openeye Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(2-nitrophenoxy)acetamide CAS Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(2-nitrophenoxy)acetamide IUPAC Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(2-nitrophenoxy)acetamide Traditional Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(2-nitrophenoxy)acetamide Formula: C17H16N2O6 MolecularWeight: 344.31874

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)CNC(=O)COC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1[C@@H](OC2=CC=CC=C2O1)CNC(=O)COC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C17H16N2O6/c20-17(11-24-14-6-2-1-5-13(14)19(21)22)18-9-12-10-23-15-7-3-4-8-16(15)25-12/h1-8,12H,9-11H2,(H,18,20)/t12-/m0/s1