ethyl (5R)-5-[(4,7-dimethoxy-6-nitro-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazole-3-carboxylate

Systemtic Name: ethyl (5R)-5-[(4,7-dimethoxy-6-nitro-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazole-3-carboxylate Openeye Name: ethyl (5R)-5-[(4,7-dimethoxy-6-nitro-1,3-benzodioxol-5-yl)methyl]-4,5-dihydroisoxazole-3-carboxylate CAS Name: (5R)-5-[(4,7-dimethoxy-6-nitro-1,3-benzodioxol-5-yl)methyl]-4,5-dihydroisoxazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl (5R)-5-[(4,7-dimethoxy-6-nitro-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazole-3-carboxylate Traditional Name: (5R)-5-[(4,7-dimethoxy-6-nitro-1,3-benzodioxol-5-yl)methyl]-2-isoxazoline-3-carboxylic acid ethyl ester Formula: C16H18N2O9 MolecularWeight: 382.32212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NOC(C1)CC2=C(C(=C3C(=C2OC)OCO3)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=NO[C@@H](C1)CC2=C(C(=C3C(=C2OC)OCO3)OC)[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O9/c1-4-24-16(19)10-6-8(27-17-10)5-9-11(18(20)21)13(23-3)15-14(12(9)22-2)25-7-26-15/h8H,4-7H2,1-3H3/t8-/m1/s1