3-[[(2S)-6-bromanyl-2-phenyl-4H-1,3-benzodioxin-8-yl]methoxy]-2-nitro-pyridine

Systemtic Name: 3-[[(2S)-6-bromanyl-2-phenyl-4H-1,3-benzodioxin-8-yl]methoxy]-2-nitro-pyridine Openeye Name: 3-[[(2S)-6-bromo-2-phenyl-4H-1,3-benzodioxin-8-yl]methoxy]-2-nitro-pyridine CAS Name: 3-[[(2S)-6-bromo-2-phenyl-4H-1,3-benzodioxin-8-yl]methoxy]-2-nitropyridine IUPAC Name: 3-[[(2S)-6-bromo-2-phenyl-4H-1,3-benzodioxin-8-yl]methoxy]-2-nitropyridine Traditional Name: 3-[[(2S)-6-bromo-2-phenyl-4H-1,3-benzodioxin-8-yl]methoxy]-2-nitro-pyridine Formula: C20H15BrN2O5 MolecularWeight: 443.2475

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OC(O1)C3=CC=CC=C3)COC4=C(N=CC=C4)[N+](=O)[O-])Br

Isomeric SMILES

C1C2=CC(=CC(=C2O[C@H](O1)C3=CC=CC=C3)COC4=C(N=CC=C4)[N+](=O)[O-])Br

InChI

InChI=1S/C20H15BrN2O5/c21-16-9-14(11-26-17-7-4-8-22-19(17)23(24)25)18-15(10-16)12-27-20(28-18)13-5-2-1-3-6-13/h1-10,20H,11-12H2/t20-/m0/s1