(4R,5S)-5-(6-bromanyl-4,7-dimethoxy-1,3-benzodioxol-5-yl)-4-methyl-4,5-dihydro-1,2-oxazole-3-carboxylate

Systemtic Name: (4R,5S)-5-(6-bromanyl-4,7-dimethoxy-1,3-benzodioxol-5-yl)-4-methyl-4,5-dihydro-1,2-oxazole-3-carboxylate Openeye Name: (4R,5S)-5-(6-bromo-4,7-dimethoxy-1,3-benzodioxol-5-yl)-4-methyl-4,5-dihydroisoxazole-3-carboxylate CAS Name: (4R,5S)-5-(6-bromo-4,7-dimethoxy-1,3-benzodioxol-5-yl)-4-methyl-4,5-dihydroisoxazole-3-carboxylate IUPAC Name: (4R,5S)-5-(6-bromo-4,7-dimethoxy-1,3-benzodioxol-5-yl)-4-methyl-4,5-dihydro-1,2-oxazole-3-carboxylate Traditional Name: (4R,5S)-5-(6-bromo-4,7-dimethoxy-1,3-benzodioxol-5-yl)-4-methyl-2-isoxazoline-3-carboxylate Formula: C14H13BrNO7- MolecularWeight: 387.15952

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(ON=C1C(=O)[O-])C2=C(C3=C(C(=C2Br)OC)OCO3)OC

Isomeric SMILES

C[C@H]1[C@H](ON=C1C(=O)[O-])C2=C(C3=C(C(=C2Br)OC)OCO3)OC

InChI

InChI=1S/C14H14BrNO7/c1-5-8(14(17)18)16-23-9(5)6-7(15)11(20-3)13-12(10(6)19-2)21-4-22-13/h5,9H,4H2,1-3H3,(H,17,18)/p-1/t5-,9+/m1/s1